#DEFINITION	Reference Metabolome for Allium sativum
#IDENTTFIER	RefMeta-Allium sativum.R1
#FORMAT	msr
#VERSION	1.0/R1
#KEYWORDS	RefMeta
#ORGANISM	Allium sativum
#CREATION	31-MAY-2024
#PUBLICATION	CropMetabolome: a comprehensive metabolome database for major crops cross eight categories
#JOURNAL	The Plant Journal
#AUTHORS	Shi H, Wu X, Zhu Y, Chen P, Xu X, and Li X.
#COMMENT	Reference metabolome for Allium sativum was generated from multi-tissue LC-MS/MS data with redundance removed
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1259.592
Annotation	(2a,3b,5a,6a,22R,25R)-Furostane-22-methoxy-2,3,6,26-tetrol 3-[glucosyl-(1->2)-[xylosyl-(1->3)]-glucosyl-(1->4)-galactoside] 26-glucoside
Peak:m/z	Relative Intensity
449.4227905	0.08
477.3601074	0.02
527.5881348	0.05
578.6502686	0.05
593.4881592	0.08
611.5069580	0.14
633.6619873	0.03
651.2301636	0.03
709.3236084	0.02
719.3652954	0.04
755.3353271	0.04
771.5052490	0.08
772.2338867	0.07
773.4805908	19.78
774.0996704	0.13
781.5163574	0.04
782.4924316	0.26
815.8189087	0.04
818.5002441	0.05
837.5095825	0.02
853.8715820	0.02
863.4454346	0.06
869.6253662	0.12
881.2713623	0.56
881.9530029	0.06
917.6245117	0.71
933.2634277	0.04
934.5120850	0.47
935.5766602	15.74
977.4874268	0.11
1004.8515620	0.02
1060.5615230	0.08
1079.5061040	0.32
1083.1684570	0.04
1095.8122560	0.27
1097.4963380	100.00
1098.2576900	0.12
1153.3616940	0.03
1156.5532230	0.08
1205.5604250	0.10
1214.6145020	0.06
1217.4973140	0.11
1240.4929200	0.05
1241.7059330	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	368.0654
Annotation	Unknow
Peak:m/z	Relative Intensity
110.9321671	0.33
112.7852936	0.06
125.2358932	0.05
129.0156250	0.42
135.0616455	0.54
135.8988037	0.17
143.0155334	6.27
150.5483398	0.09
173.0410767	37.23
176.0055542	10.22
184.1790466	0.09
189.3965149	0.06
190.8940735	6.84
200.2272034	0.18
218.1596680	0.12
245.3327942	0.23
260.1288452	0.72
279.9295959	0.20
282.8867188	0.06
288.0035095	0.15
291.9151306	0.98
310.1295776	0.76
324.1571655	0.06
332.1569214	0.31
349.9355164	100.00
350.5969238	0.62
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1089
Annotation	Lactulose
Peak:m/z	Relative Intensity
101.0269165	6.09
112.9934845	18.10
118.9243927	10.45
124.8018646	3.97
130.9190063	6.04
143.0115509	17.42
148.8819885	4.86
160.9930115	18.41
176.0874939	0.10
178.9336853	100.00
221.1045227	0.43
262.1222534	0.45
280.9481506	1.71
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	476.2779
Annotation	PE(18:2(9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
140.0561218	0.09
153.0243378	0.10
176.8480835	0.03
196.0473480	0.20
214.1139221	1.48
233.1731873	0.01
261.4653015	0.04
279.2565002	100.00
332.1298523	0.02
360.9213257	0.02
413.0766296	0.07
430.2240906	0.04
460.4296875	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	683.2253
Annotation	Lactulose
Peak:m/z	Relative Intensity
221.1949310	0.21
222.3755188	0.02
324.0656128	0.11
326.2255249	0.07
339.2286377	0.21
341.2249756	100.00
342.2512817	0.67
343.1054993	0.27
503.1767578	6.54
504.3175659	3.98
505.3466187	9.78
506.2714233	1.59
520.2387085	0.11
521.3132935	0.42
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	549.1672
Annotation	Unknow
Peak:m/z	Relative Intensity
176.0884094	0.03
189.1114960	0.54
207.0399323	41.03
341.1545410	0.03
371.4044189	0.02
372.2777710	0.05
503.2284546	100.00
503.8366089	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.1294
Annotation	Arborescoside
Peak:m/z	Relative Intensity
113.1177216	0.21
127.1133041	0.23
135.1343384	0.25
143.1347046	0.39
146.0691528	2.67
161.0516663	2.95
162.1415405	0.30
163.2391052	0.38
164.0753784	4.15
179.0422058	100.00
207.0583038	10.28
224.1868896	0.36
269.4014587	0.15
281.1403809	0.18
289.2296448	1.57
297.9791260	0.11
327.2861328	0.24
337.2151794	0.19
340.4560242	8.32
341.0957642	25.13
353.3561096	0.14
355.1173401	0.17
359.3742676	0.20
368.2887268	0.18
369.3235168	0.62
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	482.1089
Annotation	Unknow
Peak:m/z	Relative Intensity
140.9911804	0.11
147.9517365	0.09
151.1611938	0.13
159.8928070	0.21
175.9556122	0.04
178.0183258	0.32
189.0468903	0.04
199.2969360	0.05
217.8350677	0.11
222.2987518	0.06
223.2169495	0.21
231.1139832	0.44
233.3411865	0.05
245.2174072	0.12
245.9639587	0.14
249.1856384	0.27
250.2040710	0.12
254.3610840	0.11
259.9664001	0.19
263.0684204	10.10
265.0942993	0.50
267.1321106	0.13
271.2098999	0.09
274.5520935	0.12
279.0166931	0.04
283.2685852	0.06
286.0493164	0.09
287.0294189	0.18
293.3264160	0.17
294.9642334	1.11
296.1903381	0.20
300.2005310	0.03
302.4146118	0.04
305.0486145	5.07
305.7006836	0.21
307.8046875	0.16
319.0984497	0.15
320.1800842	0.04
326.1684570	0.09
328.7824707	0.06
330.7833252	0.18
332.3406372	0.33
336.2362671	0.08
345.4682617	0.07
346.4195251	0.12
353.1570435	6.98
358.5920410	0.15
360.2289124	0.51
361.2705383	0.16
371.8165283	0.39
374.1049805	1.83
375.3416748	0.03
383.6906128	0.17
386.1155090	0.19
388.5418701	0.10
392.1643372	100.00
406.2876892	0.80
410.1937561	0.32
419.3508606	0.16
423.1301575	0.31
424.1336060	2.92
437.0545654	0.24
438.3603210	0.23
439.1823120	0.31
441.0627136	3.69
446.9497986	0.03
463.1554260	1.20
464.0641785	1.91
472.3016663	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	272.9587
Annotation	Ribose-1-arsenate
Peak:m/z	Relative Intensity
114.9157257	5.49
130.8775940	0.46
157.0768433	0.03
158.9027100	100.00
159.6841431	0.03
161.0143280	0.05
198.9108887	1.36
216.9904480	1.11
228.9149170	26.83
245.0277710	0.53
254.6364136	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	413.14
Annotation	t(6)a
Peak:m/z	Relative Intensity
119.8492889	0.32
130.1451263	0.05
136.0039673	0.36
145.8799438	0.02
161.9328766	1.24
163.4380188	0.09
164.0531616	0.02
165.2402954	0.12
170.2137146	0.05
172.971756	0.02
186.0907593	0.04
187.7994537	0.02
189.2399597	0.02
191.9727173	0.09
193.0258789	0.03
204.0215302	0.03
205.1581268	0.48
206.0611115	0.12
207.2716064	0.06
208.9954987	0.06
212.9512939	0.15
219.6017761	0.05
220.3218994	0.04
229.8840027	0.02
231.9885559	0.07
239.2690735	0.02
246.1625061	0.10
247.0621338	0.08
251.2477417	0.24
252.1339111	0.02
259.1792603	0.07
260.5602417	0.02
265.1820679	0.02
266.2526245	0.16
268.1693726	4.23
272.8453674	0.16
273.9249878	0.02
275.3401489	0.10
277.9008789	0.02
279.1491394	0.05
281.1062317	100.00
282.0121765	0.16
283.3197632	0.79
284.0995178	3.77
289.2338257	0.03
291.117157	8.22
292.1863098	1.20
293.1450195	4.65
294.1430664	0.72
300.1383667	0.04
322.8158875	0.21
325.080719	0.02
328.3002014	0.01
329.2719727	0.08
332.4357605	0.03
333.3470459	0.04
341.3420105	0.03
347.019928	0.08
350.3432617	0.07
351.3624573	0.03
354.1037598	0.09
359.3247375	0.05
368.0375671	0.07
368.9568787	0.16
369.8071594	0.12
373.2842712	0.09
375.0739441	0.06
376.4161682	0.17
377.1922607	0.18
388.4085388	0.05
390.3712463	0.13
391.3509216	0.07
395.0705566	0.41
396.0969849	0.12
397.4519348	0.02
398.5031128	0.18
403.5517883	0.18
407.1297913	0.04
413.8177185	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	254.0856
Annotation	Unknow
Peak:m/z	Relative Intensity
86.5879593	0.08
88.9398041	30.46
103.8747864	0.05
109.8697357	0.07
113.2579956	0.10
124.7396851	0.39
126.0491943	0.14
141.9363556	0.11
142.7503815	0.20
152.0560455	100.00
163.9555206	0.55
167.9171906	0.35
179.7382050	0.08
185.9745178	0.11
187.2421722	0.15
192.2678680	0.35
195.3230591	0.34
196.2370605	0.09
208.0174713	0.09
209.3586884	0.22
210.1237640	0.10
213.0726929	16.47
217.8764648	0.17
233.4152222	0.09
235.1627808	0.10
236.0257721	0.29
254.2471161	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	587.2356
Annotation	L-gamma-Glutamyl-beta-phenyl-beta-L-alanine
Peak:m/z	Relative Intensity
164.1579590	0.01
171.2478638	0.03
185.1487732	0.03
186.1324005	0.03
210.2059021	0.00
213.1742096	0.33
214.1767883	0.04
231.2144470	0.09
249.3413544	0.01
257.2351685	2.37
258.3457031	0.05
275.1878052	9.43
276.3097229	0.20
293.1587524	100.00
294.1779785	1.27
359.6913452	0.02
427.1619873	0.03
470.4912109	0.02
484.0862427	0.01
568.6198730	0.01
569.2352905	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	420.1426
Annotation	Jadomycin A
Peak:m/z	Relative Intensity
122.0578918	0.22
123.9820557	0.10
127.7723160	0.07
129.9150238	0.46
130.9008484	0.02
142.3160400	0.06
144.9672241	4.31
156.1413269	0.06
161.9674683	14.68
170.1695557	2.94
177.9657898	0.07
182.2539368	0.08
188.1207123	0.42
198.0447083	0.03
200.9685669	0.12
203.0805969	0.06
205.1381531	0.14
213.3149109	0.12
216.4608154	0.02
217.2958984	0.02
227.4621124	0.16
228.0696869	0.72
231.1152344	0.03
233.1577759	0.29
234.1097107	0.49
241.1298828	0.94
243.0542908	0.08
245.0778809	0.65
251.1496277	7.37
258.1019897	0.05
259.0966492	0.94
266.2183228	0.02
273.1240540	1.47
274.1130676	1.03
277.2199707	0.19
291.1056519	100.00
291.9267578	0.01
292.8357239	0.02
298.0628052	0.03
299.2240601	0.30
302.7443848	0.09
305.3362122	0.10
309.9846802	0.08
311.9424744	0.21
315.1384277	0.02
317.1800537	0.10
320.0776978	0.25
330.1537170	3.03
338.9219971	0.05
346.4910278	0.13
354.2980042	0.04
357.1610718	0.54
361.3643188	0.07
371.4800720	0.05
375.0097046	0.43
375.7981262	0.05
379.4838562	0.13
384.0524902	0.09
398.4952393	0.26
401.5935364	0.11
402.2687683	1.07
403.2391968	0.84
410.6570129	0.27
412.5325623	0.09
420.4870605	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	337.0776
Annotation	L-Ascorbic acid-2-glucoside
Peak:m/z	Relative Intensity
97.1512833	0.04
98.9299316	0.28
100.9329758	0.15
110.9420929	0.23
112.9746017	1.51
113.8850250	0.28
114.8957062	0.61
118.8915405	0.03
120.8730621	0.05
125.0628204	0.20
127.0062485	0.78
129.0136414	0.70
131.0471954	0.07
136.9208679	0.06
138.9003754	0.52
141.0101624	0.10
143.1319275	0.20
144.9375610	0.03
148.9542847	0.54
153.0669861	0.09
155.0266113	0.12
156.9951782	1.17
169.0725250	0.61
173.0319977	0.04
174.0219421	1.36
175.0911560	1.31
186.2117462	0.02
186.9755859	0.09
189.1658020	0.04
193.2431946	0.15
199.0083313	0.10
204.0086823	0.06
207.0447388	0.06
207.9676208	0.09
219.3234253	0.14
223.2364197	0.02
229.0742798	0.10
233.0538635	0.10
235.1358948	0.04
237.3586426	0.03
240.8481445	0.04
247.1137085	0.11
250.0490417	0.03
258.2322998	0.02
261.1094666	0.01
274.9780273	0.02
277.1488953	100.00
278.0215759	0.03
289.4817810	0.05
319.1524658	0.72
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	355.1034
Annotation	Veranisatin B
Peak:m/z	Relative Intensity
130.6672516	0.16
134.0111694	0.97
146.0112762	0.08
147.1708374	0.13
149.1924133	1.05
173.9975281	0.10
174.8991699	0.07
178.1391754	1.77
186.9118042	0.12
191.0159912	1.43
193.0355225	100.00
209.0237732	1.10
214.9447327	0.16
217.2692871	0.17
230.0848999	2.24
233.1023865	0.12
234.1309204	0.24
235.2423401	0.68
237.0187683	0.13
242.8086853	0.09
252.1723938	0.06
259.0206604	0.20
268.8240051	0.09
292.9965820	0.11
294.2891235	0.12
295.2115479	0.62
299.3698120	0.18
307.2736206	0.37
309.2745667	0.38
311.1028442	1.17
313.3158569	0.21
314.9190063	0.62
318.8078613	0.71
327.1312561	0.14
335.4158325	0.91
336.1379089	0.22
337.2451782	1.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	603.2504
Annotation	(+)-Cycleatjehenine
Peak:m/z	Relative Intensity
210.8818054	0.06
281.3960571	0.09
300.9296265	0.02
351.2628784	0.02
365.6035156	0.02
368.8280029	0.01
403.4539185	0.05
421.4639893	0.03
429.1606445	0.02
442.0280762	0.01
446.5717773	0.05
447.4403687	0.01
453.2291260	0.16
468.8065796	0.01
472.0366211	0.04
473.1203613	0.07
482.1880493	0.18
497.2540894	0.06
510.3588867	0.02
531.1909180	0.01
542.9849854	0.03
545.2006836	0.13
555.0656128	0.05
557.3163452	100.00
557.9612427	0.49
559.3193970	0.04
566.1378174	0.06
566.9502563	0.06
567.8655396	0.04
584.4310913	0.14
585.5088501	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	476.2778
Annotation	PE(18:2(9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
140.0153351	0.13
152.8503723	0.03
196.0034485	1.95
205.1810303	0.03
214.1850433	0.90
221.7529144	0.02
259.2955933	0.02
261.3928528	0.19
278.0065918	0.07
279.2465820	100.00
279.8705750	0.44
323.3715820	0.06
373.1168823	0.06
376.0546570	0.03
404.4714355	0.05
405.1471252	0.06
415.2532654	0.21
422.0415039	0.04
430.3514709	0.03
457.8370361	0.10
460.6276550	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.0183
Annotation	Unknow
Peak:m/z	Relative Intensity
96.9763260	0.77
97.8472443	0.22
99.0194550	0.13
101.0028076	1.28
102.9182434	1.02
104.9404144	5.50
106.9699936	2.70
109.0179749	0.52
110.9479218	5.53
112.0445099	4.51
112.9410706	53.76
113.7801666	0.38
114.9969940	7.87
116.9627075	0.04
118.8972626	1.30
120.9914856	1.14
123.0464325	0.39
124.9943390	0.36
126.8612366	0.56
128.9856262	17.27
130.2218933	0.68
130.9389648	3.71
132.9497681	0.26
135.1862335	0.80
136.8828430	12.09
138.0941620	0.06
138.8631592	1.05
140.9036255	0.26
142.9452057	3.67
144.8870850	100.00
146.9067078	3.17
148.8782959	0.35
150.8769836	1.11
151.8900757	0.46
152.9912109	1.64
154.8870239	5.30
157.1228027	1.59
159.0579681	0.38
161.0071411	8.81
162.2803040	1.08
162.9213562	9.90
164.8945923	0.42
168.9232788	3.65
170.8981628	0.96
171.9672852	0.29
173.1351624	1.65
174.9850006	5.26
176.9874878	18.34
177.9748230	0.53
178.9063873	1.01
179.7503662	0.11
180.8329620	0.22
183.1343384	1.91
185.0415955	5.19
186.0823517	0.81
187.0286713	2.94
190.8421326	0.20
192.8272400	1.54
194.9807434	11.11
196.9552307	0.25
199.3917847	0.09
200.9036560	0.97
203.0374298	7.03
204.9821320	0.86
207.1060791	0.05
209.0767517	0.33
211.0523682	0.54
217.1543274	2.82
218.8592529	74.90
226.9998779	0.96
231.2945557	0.06
231.9891052	0.13
234.9182434	13.28
236.0042114	3.86
241.1985168	0.26
245.0146484	0.22
247.2333984	0.44
248.9930115	0.63
251.0927734	0.09
253.0387878	0.17
258.9724121	0.12
266.8550415	42.53
267.5101318	0.17
277.0537109	0.37
290.6670532	0.20
291.2752991	0.16
295.2431641	0.45
297.0863037	0.38
299.0955811	1.11
299.9123840	0.17
305.3306274	1.14
313.3004150	0.61
315.4313965	0.49
323.3429871	26.43
340.6097412	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	485.1775
Annotation	Unknow
Peak:m/z	Relative Intensity
143.0596466	1.06
144.9671783	1.28
146.0076904	5.57
147.0297394	0.47
148.8837891	0.13
149.9091187	0.05
154.8160553	0.07
159.0611267	1.76
160.1509857	5.06
161.0597839	41.44
162.1495667	3.31
169.3465881	0.12
171.0619965	0.11
173.0240173	0.90
174.0295410	0.14
175.0499420	7.22
176.1277618	1.44
178.9634399	0.83
180.0105133	0.26
185.1640930	0.48
187.0907440	0.69
189.0527344	84.45
190.1622314	11.92
197.3781433	0.17
201.0331268	0.51
203.0702820	34.04
204.0852051	6.36
210.1940765	0.10
213.2690277	0.17
215.1187439	0.96
216.2512360	0.13
217.2754364	0.08
218.1692047	0.18
219.1803894	0.04
221.0361328	13.00
222.0188599	1.64
226.4209900	0.04
227.0729828	0.10
229.1356812	2.45
230.1633606	0.77
231.0074921	1.70
232.0790405	0.19
232.7738037	0.29
234.1223755	0.11
236.0041046	0.05
242.1840057	0.06
245.2467957	0.57
246.0069580	0.09
257.1461487	0.05
259.4017029	0.07
261.5084534	0.19
269.0710449	0.21
270.2774353	0.06
273.0770264	0.05
275.4759827	0.20
277.1853027	2.26
278.1882324	1.36
282.3642273	0.08
287.1360474	1.31
288.1627502	0.42
293.3758240	0.12
294.2003479	0.32
295.2369385	2.10
296.2770691	0.45
305.1253662	100.00
306.2491455	29.29
323.2013550	21.77
324.2542114	5.61
329.2589722	0.07
347.2526855	0.09
357.2543335	0.05
359.0598145	0.07
360.5318604	0.11
366.4732666	0.04
380.2615662	0.09
414.1423645	0.33
421.2287903	0.32
422.0809631	0.18
423.2973938	0.30
426.2238464	0.10
439.1820374	0.58
440.1112976	0.49
441.4100952	0.07
442.1573792	0.05
445.1013489	0.20
449.4144287	0.72
450.2890015	0.29
457.2711487	8.11
458.3115540	2.87
467.2608032	27.04
468.2690735	7.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	324.07
Annotation	Unknow
Peak:m/z	Relative Intensity
101.0933838	0.15
104.8281708	1.31
111.9827728	0.06
113.1056824	1.04
115.8852081	0.03
136.0330963	0.06
141.9481201	0.05
143.1524353	0.07
146.8553467	8.56
149.0565796	0.07
152.0818176	0.12
153.0545654	0.07
160.0188599	2.21
161.9714813	0.11
163.2372284	0.06
165.2513123	0.17
165.9738159	0.04
175.1667023	0.04
178.0568237	0.28
183.8905640	0.07
184.9685974	0.05
192.1275787	0.09
194.0339508	1.02
195.0353088	0.57
199.9700317	0.45
202.2308044	0.11
212.1448669	1.74
215.1962585	0.18
218.2344666	0.14
221.2870178	0.19
232.4595642	0.13
233.9423218	100.00
235.4236145	0.07
238.1991272	0.04
240.3633118	0.12
242.9604187	0.13
245.4848022	0.11
250.0892639	0.61
252.0847778	0.04
253.4845886	0.10
255.5091858	0.06
256.2759094	0.09
261.3537292	0.07
262.3234253	0.11
265.9148865	0.84
268.1223450	49.26
272.1517029	0.09
275.2597656	0.21
277.4024658	0.10
279.2471313	0.70
280.4969482	0.20
281.1367798	0.14
282.9132690	0.17
287.1120605	0.10
288.4380798	0.17
289.2250366	0.06
291.1449585	0.14
292.0048828	0.07
295.2027893	0.06
303.2473755	0.05
305.1843872	0.41
306.1089783	0.88
306.8853455	0.47
308.2587891	0.04
314.4404907	0.37
318.3751831	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	162.0579
Annotation	trans-S-(1-Propenyl)-L-cysteine
Peak:m/z	Relative Intensity
54.8850784	0.07
58.0162201	1.52
59.0934296	0.02
71.9868393	0.02
73.0830536	0.02
75.9323883	0.59
89.8410645	0.04
99.0012665	0.20
104.9581451	0.07
115.9205322	7.88
116.9131165	0.06
126.8780365	0.03
132.8166351	0.02
133.9757538	0.34
145.0090027	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	318.3
Annotation	4-Hydroxysphinganine
Peak:m/z	Relative Intensity
92.96807098	0.19
94.92163849	0.16
109.1071625	0.15
110.9144592	0.18
116.133522	0.18
123.0473175	0.57
125.0485764	0.39
128.7007904	0.14
133.2454529	0.18
137.0515289	0.48
137.956955	0.11
145.1833801	0.22
145.9151306	0.07
146.8801575	0.11
148.9514465	0.46
151.3601227	0.13
152.4971924	0.12
153.2054749	0.21
154.797821	0.84
157.1077881	0.80
157.9314728	0.23
163.045639	0.11
165.2188263	0.36
167.0033569	0.47
169.1162872	0.21
169.7866974	0.32
171.2971191	0.60
177.0039978	0.10
179.2184448	0.91
183.4363556	0.28
185.3308716	0.35
187.202179	0.18
193.1435394	0.40
195.0702667	0.23
199.0321045	0.19
200.9672089	0.31
204.6445312	0.23
210.2877808	0.11
211.4353638	0.08
212.1889648	0.65
213.1645203	0.30
214.467041	0.13
216.0664368	0.10
219.1163635	0.21
223.1513977	0.08
225.1188049	0.70
227.3707275	0.24
228.1599731	0.39
229.6544495	0.98
231.3520508	0.16
232.9961548	0.11
235.2846375	0.29
237.6208801	0.95
241.1311646	0.37
244.1382446	0.74
244.8561401	0.33
247.3114319	1.76
252.5597839	0.39
254.2152405	0.14
256.3821716	0.87
260.8817139	0.18
262.2713013	0.74
264.5923157	3.24
265.4202576	3.19
269.1829529	0.11
270.3345337	0.94
272.7302551	2.54
274.2745361	0.11
276.0666809	0.13
277.3353882	0.11
282.2835388	37.36
283.1835938	0.53
285.1196594	0.11
286.7025757	0.21
287.3551941	0.32
288.8832703	0.17
290.2008667	0.20
300.2868347	100.00
301.0571594	3.37
304.486145	0.17
309.2865601	0.11
318.2252808	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	291.08
Annotation	N,N'-Ethylenediaminedisuccinic acid
Peak:m/z	Relative Intensity
85.9233246	0.24
86.9177856	0.14
110.2761612	0.21
121.0644073	0.46
125.7915573	0.05
127.9121246	100.00
129.0012512	24.43
130.0435181	9.03
153.0237122	2.25
154.0283661	0.61
155.0831909	0.47
159.1987000	0.05
160.0119934	0.09
161.2437134	0.76
162.0129395	0.59
167.3923798	0.07
171.0638428	13.16
172.1803131	4.22
173.0081635	1.62
179.0025330	0.28
180.0158997	0.21
181.0579529	0.09
185.0042725	0.06
196.9796143	0.59
198.1863403	1.36
199.7629089	0.44
202.0691223	0.14
215.0804443	8.73
216.1286011	6.36
217.1434937	3.05
229.1739502	0.26
245.8912964	0.08
249.4028015	0.07
252.7574768	0.14
254.1423950	0.38
255.0306702	2.64
272.1334839	12.04
273.1302490	18.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	538.13
Annotation	Unknow
Peak:m/z	Relative Intensity
178.9579468	0.16
181.0889587	0.28
183.8789978	0.13
195.9543457	0.22
199.1672058	0.18
208.9759674	0.10
212.2108307	0.15
229.3125305	0.08
231.0593567	3.01
235.0481262	0.52
246.1025543	0.39
263.1586304	0.26
280.0368652	0.11
280.7836914	0.16
283.1049194	0.11
288.2583618	0.27
289.2157898	0.67
298.2889404	0.56
302.5518188	0.20
306.0648193	9.08
315.9858398	0.24
317.0596924	2.25
320.8001709	0.14
322.2415771	0.32
330.2553711	0.23
334.0121460	100.00
334.6870117	0.29
358.5087891	0.36
360.9663086	0.12
364.4322510	0.07
376.3319702	2.95
391.1725464	0.94
392.0783081	0.20
400.0001221	0.15
409.1316528	84.51
445.3147583	0.44
463.1828003	0.77
479.1557007	0.11
501.9333496	0.17
502.9937134	0.13
504.0006714	0.12
505.0501099	0.16
520.2881470	10.30
521.1733398	0.45
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	324.09
Annotation	Unknow
Peak:m/z	Relative Intensity
115.9160767	0.07
117.0638123	0.03
144.6651001	0.27
146.9112549	0.28
149.0495605	0.02
156.1000366	0.06
162.1092377	0.41
163.0111694	0.08
174.0883026	0.07
177.0005493	0.03
178.0402069	4.62
179.9640503	0.06
181.8645020	0.04
184.1470642	0.21
194.1470642	0.20
204.0159912	0.02
206.9651794	0.03
208.2590027	0.06
212.0104065	2.31
215.9913635	0.32
216.9695129	0.05
224.0931396	0.07
229.0979309	0.05
231.9320068	0.22
233.2555542	0.07
233.9191284	0.03
235.3287048	0.05
236.0895691	0.22
237.0417480	0.04
239.0469055	0.06
240.9664307	0.13
247.0687256	0.12
247.8979187	0.13
248.6485291	0.03
252.1898499	0.15
260.0789185	0.27
265.1245728	0.04
268.2147217	100.00
270.2788086	0.04
277.2337646	0.05
278.2261353	0.12
279.1030884	0.02
280.1699219	0.36
282.9037476	0.11
287.3541260	0.24
288.1945190	0.12
295.2647095	0.07
296.4644165	0.25
298.0391846	0.04
301.0662537	0.20
305.4309692	1.00
306.1769409	1.42
307.2508545	0.42
308.3992920	0.33
314.4995422	0.15
324.3090515	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	175.1186
Annotation	L-Arginine
Peak:m/z	Relative Intensity
59.8330841	41.42
69.9198303	4.21
71.7515869	0.62
96.9538727	0.22
97.9918976	0.56
111.8802643	6.68
113.0338898	0.56
114.0165710	3.52
115.9506226	56.27
129.9676056	36.18
133.1381989	0.77
140.0538635	2.55
141.3196259	0.40
156.9940033	75.87
158.0145874	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	319.12
Annotation	fluvoxamino acid
Peak:m/z	Relative Intensity
96.2493591	0.08
96.9480133	0.39
97.9591217	0.85
98.9464340	0.99
99.9083939	0.19
101.0998840	0.14
101.9406586	0.20
102.9202499	0.70
107.8219757	0.19
110.0018005	8.17
110.9722900	2.01
112.0239563	7.12
112.9304657	0.03
114.0544434	1.90
115.2839050	0.15
116.0023956	1.08
124.1591492	0.13
125.0682373	0.09
126.9977417	3.91
129.9851685	1.19
132.2245026	1.02
132.9749451	0.26
136.2088013	0.16
136.8108215	0.21
138.1110229	0.06
139.9517212	1.15
142.9910278	0.72
145.1059875	1.53
145.9615173	0.06
150.0416260	0.19
152.0549927	1.20
153.1012421	0.35
154.0495605	3.04
155.1225891	0.16
157.0200500	3.11
158.0101318	8.33
163.9406128	0.07
167.9128265	0.99
169.1174011	25.65
171.2884064	0.23
172.9622192	0.48
174.0435028	6.90
175.0200958	17.20
175.6983032	0.14
178.1207886	0.31
178.9739380	0.20
184.9591675	0.12
186.9786530	1.28
188.0768738	2.55
195.0901337	11.16
196.1801605	2.10
197.1651917	2.12
198.2233276	1.19
199.1425781	0.38
200.9410400	0.46
201.9926453	0.19
204.0926208	0.22
205.1549377	0.11
209.3171692	0.28
213.1240845	29.47
214.1705627	44.22
216.0636902	0.11
224.9846497	0.19
228.4753418	0.57
229.1758423	1.15
230.1797180	0.66
231.2329712	0.48
234.1132812	1.04
236.7903137	0.13
237.9613647	0.30
238.5648499	0.12
240.2521973	0.22
244.0478516	0.32
245.0444336	5.04
247.0764465	63.37
254.4424133	0.95
255.1679688	0.15
256.0185852	0.25
257.1293945	0.35
258.1777344	0.28
259.1690063	0.49
260.1720581	4.06
261.2109375	1.63
261.8264465	0.53
263.2739258	0.16
265.0357971	0.16
272.7929077	1.95
274.0185547	0.55
274.9116211	0.97
278.1197815	100.00
281.0809021	0.90
283.1810913	0.16
284.0820923	0.28
284.8254089	0.56
287.3280640	0.31
289.7921753	0.27
290.4346924	0.09
291.0964966	0.21
297.0346680	0.24
298.8610840	0.20
300.0673218	1.41
301.0947876	26.68
302.1238403	6.03
309.9714355	0.57
310.6724243	0.54
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1027.3
Annotation	Unknow
Peak:m/z	Relative Intensity
502.9186096	0.21
648.2306519	0.09
649.0479126	0.31
707.3370361	0.24
827.2462158	0.41
864.7186279	0.14
869.2802734	0.37
989.3081055	100.00
990.4152832	31.81
991.3125000	39.08
992.0034180	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1411.4033
Annotation	Sanggenon S
Peak:m/z	Relative Intensity
665.3544922	0.17
707.1235962	0.15
827.3475952	0.10
911.2626953	0.05
971.0698242	0.03
1031.3713380	0.40
1069.7253420	0.08
1133.4631350	0.15
1151.4528810	0.12
1249.3743900	0.04
1313.3596190	100.00
1314.0324710	0.84
1393.3422850	9.97
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	686.1821
Annotation	Unknow
Peak:m/z	Relative Intensity
196.8363037	0.05
199.0134125	0.15
207.1290283	0.08
211.0035706	0.07
213.1679382	0.21
218.8828125	0.59
223.2644958	0.13
228.9026794	0.43
240.6198120	0.08
241.2897644	0.29
247.1482544	0.33
252.8946533	1.82
254.1149292	0.14
254.7242737	0.10
259.1425781	0.57
270.8913574	2.41
271.9653625	2.17
275.4706421	0.26
276.2021484	0.53
279.2350464	0.22
281.2473755	0.94
288.9328613	2.93
289.7272949	0.07
303.2443237	0.23
311.6679993	0.11
315.1812744	1.01
320.3937683	0.21
323.0664673	0.13
324.8237915	3.87
325.4301758	0.14
326.9681091	0.17
329.8793335	0.11
333.0029907	0.12
339.0524292	0.61
341.9758911	0.10
343.3116455	0.13
351.6434937	2.50
352.9434814	18.19
353.5938721	0.11
360.6262817	1.26
361.2502441	0.23
362.1255493	6.22
362.9361572	0.28
364.4412231	0.24
377.8291016	0.25
381.2070312	1.61
396.1787109	0.09
396.8756714	0.21
398.9204102	1.04
432.6490479	5.00
434.1044922	31.66
435.0325928	0.12
440.9557495	0.48
441.9207153	9.48
443.1038208	33.24
444.7125854	0.15
445.8110962	0.15
448.1746216	0.18
450.9031372	0.41
470.8629761	1.05
477.0535278	0.09
479.8690186	0.49
481.6137085	0.37
494.9877319	0.04
497.2770996	0.44
499.3684692	0.10
501.3252563	0.81
505.0946655	0.21
506.8669434	0.44
512.8057861	0.18
513.9846802	9.92
515.1002808	30.93
516.2593384	0.39
518.9142456	0.33
523.1990356	15.11
524.1824341	60.49
525.1846924	2.68
526.2315063	0.20
528.2014160	0.27
533.1526489	0.12
539.8618164	0.65
543.1349487	6.06
554.7276001	0.13
557.9054565	0.37
561.1436157	9.67
577.7648315	0.68
578.6273804	0.41
579.9424438	0.14
586.3748169	0.46
595.2567139	4.23
596.2557373	10.22
597.4486694	0.09
600.0991821	0.29
602.9893188	0.12
604.2938843	30.94
605.1770630	100.00
605.9550171	3.40
607.1158447	0.32
607.8416138	0.26
609.0047607	0.23
611.5521240	0.70
612.6093140	0.67
613.6250610	0.08
614.3317871	0.85
617.9309692	0.10
619.8837891	0.24
621.2896118	0.14
625.6602783	0.39
630.8889160	0.11
633.2051392	0.51
644.5480347	0.54
645.8798218	0.08
647.9597168	0.20
649.5209351	0.31
653.4530640	0.45
654.2826538	0.47
660.4592896	0.25
662.6636963	1.09
664.3808594	0.41
667.9140625	1.12
701.1012573	0.22
702.1979370	0.62
702.9707642	0.87
703.9258423	0.17
705.1790161	12.93
720.2448120	0.65
721.0551147	0.75
721.9506836	1.61
723.1712036	18.97
725.1419067	0.32
762.4878540	0.19
763.2777100	0.17
764.9777832	0.41
778.9011841	0.42
795.4497681	0.12
820.3275757	0.11
822.9898682	0.10
825.2925415	0.35
826.4740601	0.14
864.2458496	0.40
865.2704468	0.28
867.0861816	14.33
867.7802124	0.14
882.0883179	0.24
883.2078247	2.38
884.6637573	4.69
885.2901001	29.09
886.1813354	0.16
957.2521362	1.09
1028.5706790	0.09
1029.2218020	1.53
1044.3797610	0.22
1045.3101810	2.99
1047.1191410	37.54
1048.0251460	0.15
1059.5551760	0.38
1207.2410890	2.26
1208.5316160	4.32
1209.2098390	32.17
1209.8419190	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1331.832
Annotation	Unknow
Peak:m/z	Relative Intensity
379.7956543	0.05
405.4421692	0.06
441.5284729	0.06
454.9801025	0.04
480.1207275	0.15
480.9042664	0.07
483.5534058	0.08
487.9633179	0.18
505.2051697	0.28
513.3641357	0.19
516.2946777	0.32
529.2623901	0.11
537.1131592	0.31
557.5197144	0.03
582.0874634	0.09
594.1265869	0.24
601.4177856	0.11
648.1541748	0.05
667.3662109	0.23
670.2388916	0.09
690.0880737	0.45
691.1339111	0.36
693.4473877	0.08
712.0621338	0.23
731.1255493	0.06
734.2869873	0.10
762.2286377	0.08
776.3230591	0.06
791.3545532	0.13
804.0084229	0.06
812.3823242	0.14
813.2567749	0.09
814.2229004	0.13
833.1508179	0.33
839.3831787	0.81
840.5714722	0.16
845.0825806	0.09
846.3419189	0.16
848.9636230	0.10
868.8620605	0.83
869.6434326	0.09
883.5155029	0.68
886.0836182	0.10
889.4698486	0.39
908.6134033	0.14
923.2274170	0.27
925.3128662	0.37
939.1712646	0.22
940.4891357	0.29
954.1461182	0.13
958.5196533	0.30
964.9538574	0.05
969.0384521	0.39
974.4863281	0.66
978.4531250	0.49
993.9787598	0.30
996.3605957	0.06
997.2106934	0.04
1004.1602780	0.05
1010.8133540	0.12
1011.4937740	0.16
1014.4060060	1.79
1021.3439940	0.08
1026.1997070	0.15
1035.1392820	0.80
1043.6245120	0.11
1044.3071290	0.10
1046.1573490	0.18
1048.2558590	0.67
1049.5004880	0.31
1050.2031250	0.21
1055.4493410	0.12
1064.0732420	0.32
1068.2121580	0.14
1069.0524900	0.13
1073.3105470	0.09
1082.9610600	0.13
1084.7890620	0.36
1088.0571290	0.40
1090.3358150	0.32
1092.6007080	0.76
1093.4720460	0.19
1098.9013670	0.06
1101.1014400	0.51
1104.3620610	0.13
1110.1264650	0.07
1111.1691890	0.03
1112.7713620	1.06
1114.7083740	0.45
1121.9241940	0.16
1123.4078370	0.40
1129.1854250	0.27
1132.9086910	0.59
1140.2358400	0.44
1142.2055660	0.76
1144.9519040	0.81
1148.7341310	0.74
1149.5153810	0.71
1150.1503910	0.81
1153.9519040	0.56
1155.4086910	0.16
1156.4570310	0.38
1157.3884280	0.42
1165.4809570	1.47
1166.5117190	0.69
1167.9056400	0.35
1169.1431880	0.81
1169.9672850	1.56
1170.7580570	1.19
1171.8468020	0.26
1173.3071290	0.53
1176.6329350	0.74
1177.4926760	0.71
1179.3493650	0.16
1180.0098880	0.38
1181.9373780	0.32
1182.7468260	0.32
1186.1617430	9.90
1186.8909910	0.29
1187.5179440	0.28
1189.9068600	0.77
1190.6833500	0.06
1193.4265140	1.10
1194.1839600	0.45
1197.0994870	1.40
1201.9300540	13.62
1202.5450440	5.36
1204.1943360	0.39
1204.9810790	0.09
1206.1284180	7.19
1207.2242430	0.40
1209.8964840	0.09
1210.8925780	0.18
1212.6958010	1.19
1213.7972410	0.43
1214.6656490	1.05
1216.0118410	0.04
1216.7114260	0.05
1218.0650630	6.78
1219.5012210	0.27
1222.0112300	6.19
1222.9775390	10.81
1223.7825930	0.13
1226.0595700	0.53
1226.8361820	0.84
1227.4910890	0.63
1228.7346190	0.15
1231.9118650	0.36
1233.3386230	0.27
1234.1232910	1.02
1237.8891600	0.82
1238.8424070	3.18
1239.4904790	4.80
1241.0170900	0.27
1241.9683840	0.56
1242.9412840	1.29
1243.6381840	1.57
1244.4833980	0.25
1249.7727050	1.11
1250.5480960	3.27
1251.2694090	0.03
1252.3648680	0.46
1253.5104980	0.54
1255.3074950	0.16
1257.4317630	0.31
1259.0710450	100.00
1260.3245850	1.44
1261.2918700	0.96
1262.4106450	0.20
1263.6588130	0.10
1264.4650880	0.09
1265.7960210	1.17
1266.6247560	3.70
1267.8041990	1.89
1268.7890620	0.23
1270.2208250	4.01
1270.9262700	1.40
1273.4042970	0.12
1275.0826420	94.01
1276.1036380	0.70
1277.3146970	0.17
1279.0502930	22.98
1279.8856200	0.68
1281.1517330	0.07
1282.7911380	0.12
1286.9234620	0.76
1287.8720700	1.48
1291.1367190	6.00
1292.5622560	0.13
1293.3563230	0.16
1295.0037840	0.65
1296.1166990	17.12
1297.0053710	0.18
1302.6000980	0.28
1305.2604980	0.13
1307.8198240	0.11
1309.0781250	0.39
1313.9924320	0.85
1314.7713620	0.13
1317.4667970	0.47
1318.5294190	0.12
1346.3933110	0.18
1369.5295410	0.16
1371.5112300	0.16
1381.5148930	0.28
1398.6512450	0.05
1403.4062500	0.12
1404.4965820	0.54
1405.2686770	0.12
1416.5037840	0.05
1431.6632080	0.21
1437.2370610	0.12
1443.6622310	0.07
1456.3919680	0.08
1471.0322270	0.11
1473.6230470	0.49
1475.3271480	0.07
1477.7496340	0.18
1492.5262450	0.20
1520.4335940	0.15
1532.4664310	0.20
1548.3322750	0.87
1549.3607180	0.15
1552.6934810	0.55
1557.1744380	0.04
1578.5222170	0.29
1589.6715090	0.14
1601.0911870	0.11
1610.7138670	0.08
1613.5133060	0.09
1617.4312740	0.37
1634.2025150	0.21
1635.5211180	0.24
1649.9042970	0.13
1666.7371830	0.15
1678.7586670	0.46
1686.1622310	0.12
1706.2211910	0.16
1709.9211430	0.15
1722.9246830	0.34
1724.5421140	0.11
1728.0152590	0.27
1740.6252440	0.03
1748.7022710	0.21
1758.7235110	0.16
1767.2556150	0.06
1777.4393310	0.21
1780.2005620	0.39
1781.4582520	0.43
1791.2803960	0.08
1800.3343510	0.13
1807.4792480	0.13
1808.2219240	0.10
1823.3615720	0.25
1824.3316650	0.33
1824.9527590	0.16
1825.5783690	0.12
1830.0252690	0.32
1842.5267330	0.24
1849.8253170	0.22
1898.2747800	0.29
1907.2943120	0.14
1918.5155030	0.11
1938.2911380	0.11
1949.2237550	0.13
1979.5603030	0.07
1995.5441890	0.27
1996.5069580	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	419.1905
Annotation	Ascleposide B
Peak:m/z	Relative Intensity
126.9523849	0.07
134.0480652	0.37
147.1181641	0.10
149.1817322	0.07
152.0593719	0.15
163.085144	0.15
163.8511505	0.95
168.1731415	0.13
198.0737305	0.37
205.0382385	0.24
215.1116333	0.17
225.9997559	0.19
231.0609589	0.22
239.0971375	0.06
250.0506287	0.21
251.2362366	0.20
253.9557495	1.70
257.1330872	100.00
257.7715759	0.24
262.3149719	0.08
273.0534668	0.14
274.6567993	0.41
275.4456482	0.54
279.4145508	0.15
282.8887329	0.05
288.2409058	1.03
290.2529297	0.21
290.9818726	0.09
293.1791382	0.26
294.4603271	0.18
296.2946777	0.17
303.2336731	0.33
306.2469482	0.10
314.2314453	0.30
328.7713623	1.20
337.2105103	0.06
338.2054138	0.48
352.316925	0.62
359.3263245	0.07
361.3877869	0.26
373.8837891	0.14
375.2713318	0.36
378.3833008	0.28
380.4787292	0.21
398.8865662	0.19
401.1727905	1.52
402.1143494	1.37
405.2360229	0.05
410.252594	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	665.2146
Annotation	Lychnose
Peak:m/z	Relative Intensity
192.9302063	0.04
197.0471344	0.06
203.2317200	0.12
214.8777618	0.05
221.0990601	1.42
233.0489807	0.25
242.9229126	0.03
250.6918335	0.50
251.3560791	0.17
261.2672729	0.04
262.2606812	0.16
263.0648804	0.23
268.4059448	0.07
280.9103699	0.24
287.3526917	0.61
303.3413696	0.07
305.0880127	0.40
317.1454468	0.04
323.1918640	4.60
334.6172485	0.13
335.2830811	0.19
341.1005249	10.47
354.1533203	0.03
358.9793701	0.05
377.4703979	0.04
383.1856079	100.00
395.1104736	1.07
407.2095337	0.35
411.2639160	0.28
413.0597534	0.14
415.3484497	0.07
425.1262207	1.40
439.2362061	0.19
442.9131470	2.78
446.0594482	0.03
456.4851685	0.09
467.0617065	0.16
473.3017578	0.07
485.1887207	10.42
487.9837646	0.03
503.3002319	12.82
504.2706909	0.15
539.2343140	0.27
545.3146362	0.43
575.6284790	0.13
588.2342529	0.12
646.7976074	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	453.1981
Annotation	Butyl (S)-3-hydroxybutyrate [arabinosyl-(1->6)-glucoside]
Peak:m/z	Relative Intensity
144.9427490	0.13
155.1359253	0.11
162.8828430	0.65
171.2596893	0.08
173.2940369	0.06
204.8984375	0.14
210.2274628	0.10
229.8722839	0.17
232.3015747	0.09
237.2232361	0.52
249.3919067	0.12
255.1193237	0.13
260.2573853	0.28
264.9959106	0.07
269.9819031	0.10
277.0522461	0.04
280.3156433	0.13
291.1173096	0.08
293.0660095	0.45
293.9758301	0.11
307.4505615	0.16
315.3893127	0.39
319.1495667	0.11
321.3700256	0.29
324.4274292	0.12
325.2521667	0.30
329.1011658	0.08
331.2185974	0.13
337.2788086	0.16
340.0380249	0.20
346.9411011	0.46
349.3326721	0.26
351.2856750	0.10
352.8876343	0.17
357.0790405	0.14
363.4906616	0.45
369.1116028	0.07
392.4615784	0.18
394.3081360	0.39
395.0516052	0.47
407.1790161	100.00
408.2251282	0.08
409.3293762	0.88
412.1530457	0.16
426.3357239	0.32
433.1469116	0.40
435.2680054	1.84
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	519.1142
Annotation	Isorhamnetin 3-(6''-acetylgalactoside)
Peak:m/z	Relative Intensity
151.1351624	0.04
163.0957642	0.04
163.9083099	0.03
175.1239624	0.02
179.0360718	0.04
189.1744385	0.04
200.034256	0.02
201.3128052	0.03
204.0704041	0.20
205.4048767	0.05
207.0093842	0.07
208.1421967	0.01
209.2006531	0.05
211.7314911	0.03
213.2308197	0.04
215.1134491	0.02
217.1870117	0.06
226.084198	0.11
229.123291	0.04
234.1951752	0.09
236.0748901	0.04
238.2572021	0.03
239.3865967	0.03
241.254303	0.03
242.3023071	0.09
243.0368958	0.10
249.1766663	0.03
254.0832367	0.05
254.8871765	0.03
256.1029053	0.06
257.0862427	0.03
261.1233826	0.04
262.9586487	0.02
271.0192261	0.39
272.1261292	0.60
273.3392334	0.03
284.0993652	0.13
285.1926575	0.29
286.2589111	0.03
287.1435547	0.61
299.0614624	0.52
300.1669312	3.79
301.3290405	0.04
303.1549683	0.04
305.7816772	0.02
307.3234253	0.06
308.0070801	0.09
309.1472778	0.02
313.2665405	0.53
315.0549927	100.00
316.0791626	0.03
316.8978271	0.04
327.3938599	0.04
329.1858521	0.25
330.1897583	0.10
339.2260132	0.08
342.2800903	0.11
343.1845703	0.04
350.0247192	0.05
352.3765259	0.01
357.1641846	0.92
358.130188	0.04
382.5531006	0.03
384.0543823	0.02
387.4956665	0.10
389.2439575	0.08
394.074707	0.05
395.3465576	0.02
398.6743774	0.03
399.5446777	0.04
400.2207642	0.08
412.5908203	0.15
416.300415	0.09
422.8735352	0.10
423.5302734	0.06
425.5300903	0.04
428.3243408	0.19
431.144165	0.07
435.3288574	0.06
444.3771362	0.04
445.2653809	0.06
451.3284302	0.03
452.3314209	0.02
454.4992676	0.11
459.2126465	0.33
460.0246582	0.09
472.256897	0.04
473.2234497	0.11
474.2397461	0.11
475.1588135	0.18
477.4450684	0.34
478.4009399	0.03
481.487854	0.06
482.3366089	0.04
487.204834	0.12
489.5534668	0.01
491.0050659	0.03
496.5553589	0.02
499.5154419	0.02
500.7664185	0.27
501.4260254	0.20
502.3910522	0.02
504.5334473	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	448.1217
Annotation	Unknow
Peak:m/z	Relative Intensity
127.8933716	0.05
152.0486450	0.04
155.0823364	0.50
168.3057404	0.28
172.0026703	0.04
177.0907593	0.04
179.1502686	0.09
194.2063293	1.55
215.2489319	0.23
217.2603455	0.11
220.1547699	0.07
228.2846527	0.32
229.1728516	0.94
238.1728821	6.04
240.2655334	0.13
243.2313232	0.10
252.2053833	0.07
253.3995056	0.27
254.0693054	0.31
264.1675415	1.48
268.1103821	11.80
269.1872864	0.85
272.1889343	19.76
278.1791687	0.22
284.2525330	0.25
288.1559448	0.10
293.9257507	0.11
295.9929504	0.06
298.0469971	8.24
299.0730896	0.11
300.0954895	0.04
310.5415649	0.12
312.1176147	4.32
314.2175903	5.56
316.0626221	1.93
318.9031677	0.32
319.6729736	0.20
328.1966858	0.65
329.3519897	0.17
333.0650940	0.16
337.9802246	1.84
338.9523926	0.41
340.1630249	0.78
346.2033997	38.14
354.3925171	0.03
356.0671692	0.12
358.1582031	12.91
372.0718689	8.97
373.0275269	0.51
373.8501282	0.22
374.4656067	0.37
390.0857849	100.00
390.6914368	1.05
405.8434143	0.09
407.0655823	85.70
407.6769104	0.36
430.0804749	2.54
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	391.283
Annotation	Di(ethylhexyl) phthalate
Peak:m/z	Relative Intensity
144.6313477	0.79
149.0280609	100.00
150.1216736	58.35
166.8853149	10.88
168.0375671	16.23
257.74823	2.25
260.9624939	21.61
261.7016296	17.10
279.027771	21.74
279.8778076	39.18
288.2265015	0.71
293.969696	0.71
300.8773804	3.46
302.8701782	3.49
320.8763733	3.27
327.3713989	1.53
328.333374	1.83
336.0752869	1.53
343.2644653	1.06
345.90448	1.89
346.984436	3.09
347.7555847	4.03
355.4477844	0.64
371.155304	2.44
372.2719421	1.63
373.7243347	0.71
374.6795654	4.89
375.290802	0.80
392.5918274	5.12
393.2658386	2.71
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	369.0122
Annotation	Unknow
Peak:m/z	Relative Intensity
110.8880310	0.13
112.8846588	5.72
121.0132141	0.07
123.1578827	0.16
124.8795471	1.30
136.9472046	12.89
141.0463562	0.24
143.1860809	0.29
153.0257263	2.78
154.8751221	100.00
166.7021942	0.05
187.1272125	0.04
189.9976959	0.07
197.1002655	1.90
205.0649719	0.13
207.1962891	0.55
214.9850616	43.89
219.1388855	0.09
221.1687317	0.04
224.0361633	0.18
228.6954956	0.50
230.3000793	0.10
243.1138306	0.16
253.1072998	0.04
255.1620483	0.04
263.1001282	0.07
271.4710693	0.05
272.9053040	0.93
275.9268799	0.08
279.1170044	0.53
280.1125183	0.14
287.1873474	0.07
288.2229614	0.35
289.0742493	0.66
290.5032959	0.10
291.3104858	0.13
294.1811218	5.48
295.2134094	1.05
296.0509033	0.06
305.1545410	0.10
307.4150391	0.12
323.8942871	0.40
327.1795959	0.67
327.9725647	0.25
332.4669189	0.13
333.4972229	0.24
334.9823914	0.22
337.5498352	0.05
338.2169189	0.19
350.1460571	0.51
351.0412292	1.20
359.9596863	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	191.0196
Annotation	Diketogulonic acid
Peak:m/z	Relative Intensity
57.0003586	0.03
84.9607239	0.52
86.9162674	1.34
101.0630188	0.03
110.8811798	100.00
128.9397125	2.36
130.8757629	0.83
146.9311981	0.04
154.9568939	0.41
172.9888458	20.85
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	297.15
Annotation	Unknow
Peak:m/z	Relative Intensity
93.0574799	0.16
111.0684967	0.07
120.0178375	0.09
136.6809387	0.05
143.2781372	0.06
153.0825195	0.05
154.9441833	0.05
156.0054169	0.23
169.9981384	0.72
177.3243561	0.05
183.0206299	15.67
183.9831085	17.30
185.0073242	0.52
192.9223175	0.05
197.0796814	0.63
198.2135925	0.54
200.8547668	0.05
203.1899414	0.13
211.3583374	0.04
212.0727844	0.13
223.0842896	0.05
225.2514343	0.53
226.1759033	0.12
227.0576172	0.16
229.1925964	0.05
233.3812866	1.45
234.3634033	0.19
235.2359924	0.41
237.3089294	0.37
239.1071777	0.34
240.2498474	0.15
241.3057556	0.10
251.4398804	1.38
253.2889404	100.00
254.2593384	0.03
259.9867554	0.30
261.2036133	0.04
267.2676392	0.03
269.2933655	0.22
269.9296265	0.08
278.4295044	0.91
279.2683105	16.83
279.9196167	0.27
281.2263184	0.15
297.2454834	6.67
298.2359619	0.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	519.1142
Annotation	Luteolin 7-(2''-glucosyllactate)
Peak:m/z	Relative Intensity
151.3546448	0.00
163.0597534	0.05
164.4511108	0.01
165.0812378	0.01
179.0755157	0.04
181.0687714	0.05
188.9616089	0.02
193.4931335	0.01
196.1646423	0.01
200.9900055	0.01
202.9232178	0.01
204.1758881	0.04
205.0029602	0.03
208.2239838	0.02
213.1897888	0.03
215.0756836	0.03
216.2414093	0.01
217.2915649	0.08
220.8361511	0.02
227.9854889	0.03
229.1530457	0.02
230.3986511	0.01
238.2487030	0.02
240.0316772	0.01
242.0253296	0.04
243.0094604	0.17
243.9983063	0.04
244.9413910	0.06
246.9810791	0.01
248.8130035	0.03
249.9232788	0.02
255.2588654	0.09
256.1615295	0.07
257.1081543	0.12
257.8545532	0.02
259.1141968	0.08
263.2122803	0.02
264.5660400	0.02
266.1111450	0.02
269.3450317	0.04
270.0460815	0.02
271.2793274	0.55
272.1513062	0.24
273.2365112	0.04
274.8900757	0.01
284.2186279	0.03
285.1985474	0.38
286.2922974	0.07
287.2274780	0.35
289.2977905	0.04
297.3300171	0.08
298.5126038	0.09
299.2825317	0.59
300.1120605	3.46
301.1286011	0.03
302.7578125	0.02
305.4880981	0.02
307.4606934	0.01
308.2246094	0.04
309.1943359	0.03
311.2379150	0.04
313.3045044	0.54
314.3955078	8.04
315.1196289	100.00
316.1625366	0.03
321.2431641	0.03
324.2785034	0.06
325.0643921	0.02
326.1475220	0.02
327.1552124	0.13
329.0869751	0.20
335.4009399	0.02
338.3780518	0.04
339.3144531	0.01
342.3438721	0.03
344.2152710	0.01
347.1801147	0.04
349.2197266	0.01
355.9809570	0.04
357.2059326	1.09
366.2554321	0.05
369.1997070	0.02
370.6842651	0.02
382.4476318	0.04
387.1712646	0.09
389.1884766	0.32
390.1924438	0.02
395.1626587	0.07
398.3485107	0.08
399.1306152	0.02
400.0664673	0.03
401.2624512	0.03
411.3679810	0.05
413.3168335	0.05
415.2635498	0.02
416.1588745	0.01
423.2973633	0.02
427.0263062	0.03
428.2413330	0.29
429.3013306	0.04
431.2497559	0.10
433.2698364	0.02
440.5639038	0.01
441.1837769	0.01
443.1618042	0.01
445.4589233	0.07
448.5669556	0.02
459.2161865	0.52
461.1228638	0.03
463.0328369	0.07
472.1820679	0.11
473.4046631	0.08
474.6147461	0.15
475.5245972	0.01
477.0989380	0.48
478.2169189	0.09
482.9959106	0.02
487.0845947	0.15
488.4635010	0.05
491.1682739	0.06
500.2235718	0.14
501.2361450	0.05
510.0949707	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	304.0609
Annotation	Oxostephanine
Peak:m/z	Relative Intensity
86.0883789	0.08
93.8708954	0.43
96.9622192	0.67
100.0216446	1.38
102.0488434	0.53
105.9366226	2.47
108.2898254	0.06
111.2635193	0.28
113.8801804	0.36
116.0071411	2.23
120.0481873	0.11
123.1650238	0.87
124.9553223	0.39
126.0112915	0.93
126.9919434	0.90
128.0650940	18.45
131.2396240	0.28
131.9186707	0.20
135.0559082	0.40
139.1408997	0.08
141.0351562	2.32
141.9110413	0.08
143.0201416	3.20
144.1712036	0.34
146.1309814	0.55
147.1585693	0.15
148.9432983	0.13
151.0509949	4.88
153.0645905	3.63
154.1124878	0.18
155.1571655	0.63
156.8097839	0.09
160.0470123	32.77
163.4425964	0.07
165.0969543	0.88
167.0763702	0.50
169.0688934	9.74
170.0452271	0.53
171.0338440	0.12
174.9660339	25.85
175.9208527	1.14
177.1102295	0.24
178.0894775	0.14
179.0776367	8.70
182.0129547	6.10
183.1864319	1.05
185.0818634	11.18
195.1968994	0.23
196.0005951	0.12
197.0345764	38.62
198.0457764	1.10
199.0153809	0.20
199.9564819	0.34
200.9802246	1.12
203.1456604	11.15
203.9231262	0.06
208.0256348	5.37
210.8473206	3.60
211.5173340	0.21
214.1712036	1.43
215.1368103	0.42
216.2239685	0.38
216.9602661	0.34
224.1232605	0.66
226.1528320	24.73
229.0076904	4.01
236.5225220	0.06
240.1527405	0.57
241.9707947	1.43
243.3362732	0.06
245.0280762	0.16
248.1011047	0.08
252.1599731	21.80
253.1271973	0.61
254.1882935	0.94
255.0174255	2.25
258.1251526	0.11
260.2103577	2.98
267.3012695	0.30
268.1567993	0.57
270.0811768	5.13
276.3088074	0.28
283.2629395	0.42
286.1174622	100.00
289.5032349	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	408.1877
Annotation	Unknow
Peak:m/z	Relative Intensity
102.6293869	0.10
128.9831238	0.59
130.0070343	1.57
132.8566895	0.31
146.9117279	0.45
150.0929413	0.64
151.0894470	0.43
159.5662384	0.48
161.1100311	0.08
162.9378662	0.07
164.9157562	0.29
165.9801331	0.07
170.0671997	0.19
174.9831390	0.46
177.9785919	0.09
182.2926941	0.12
184.5262756	0.09
185.9840393	0.07
186.8407898	0.03
192.5338898	0.24
193.3314209	0.18
195.7027588	0.12
197.2338257	0.07
201.0915222	0.64
206.3754883	0.13
207.0315857	0.08
209.9444580	0.40
215.7174988	2.30
216.3954010	0.03
218.2782898	0.13
224.0919189	100.00
224.9797668	0.34
226.3850708	0.16
227.3414612	0.34
228.0779266	0.77
229.2767944	0.30
229.9793701	0.08
231.3898621	0.05
243.0852356	0.09
244.2814026	0.10
245.3444214	0.15
254.2324829	0.38
255.0684814	0.72
258.2747803	0.18
259.1025391	0.08
260.2460632	0.02
261.1449890	0.41
262.3414001	0.03
265.1358337	0.06
266.3201599	0.12
267.0416260	0.03
268.2016602	0.04
269.4183044	0.27
272.9357910	1.73
275.9680786	0.14
277.2808228	0.11
278.1733398	0.35
279.0999756	7.00
284.2698669	0.09
291.0225220	0.40
292.6909485	0.06
297.1106873	0.46
298.3432007	0.07
300.4201660	0.14
301.3578186	0.05
308.4770508	0.75
309.1069336	4.56
310.4579773	0.04
311.9700623	0.16
316.2393799	0.11
318.1510010	5.62
318.7593994	0.07
331.0720825	0.26
334.1504822	0.15
345.3594360	0.11
349.3078003	0.10
354.1994629	0.08
360.4244690	0.06
361.9320984	0.03
363.2044373	0.11
364.2805176	0.20
366.9469604	0.07
368.8047180	1.23
376.4921570	0.05
379.0436401	0.04
389.2765198	0.64
390.2430725	1.18
391.5401306	0.13
447.3248596	23.44
466.5496216	0.14
503.5798645	0.07
531.0289917	0.07
571.6540527	0.10
624.6795044	0.05
668.3472900	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	426.2871
Annotation	Prostaglandin E2 serinol amide
Peak:m/z	Relative Intensity
133.0681305	2.33
135.2056427	1.21
135.8291473	4.79
136.8997955	6.05
148.6625671	3.70
155.0751801	5.37
161.1485901	4.76
164.3642578	4.56
171.1374054	6.30
173.117157	2.52
175.1200256	4.72
204.2792664	2.99
213.9088745	3.65
219.0898285	2.07
227.2577515	9.47
243.4194031	1.75
249.8379822	4.78
253.6503296	2.63
257.2354736	3.26
265.6813965	2.16
268.3339233	9.52
280.4266968	11.51
281.3626099	15.19
282.3881836	25.88
300.038208	2.16
306.7679443	3.58
315.0560303	6.70
320.0360413	10.17
320.7536926	3.48
321.9441833	5.40
328.2254028	3.02
332.2184143	4.67
334.2733154	3.27
335.6891479	11.84
336.3832092	1.96
339.0923462	26.77
339.78125	1.17
340.9189453	6.02
342.0906982	2.01
351.7186279	5.66
355.3609009	4.12
357.1551514	18.80
359.046936	1.21
361.3648376	1.85
366.1615601	13.38
369.0010681	4.57
373.1271057	10.91
376.9100037	3.11
380.0151062	14.02
384.1618652	3.74
388.2586975	13.11
390.1311951	3.93
394.6893311	8.71
395.5608826	12.98
398.3719788	19.59
408.2794495	100.00
409.7469788	8.65
417.0844421	13.60
426.4672546	2.98
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	579.3883
Annotation	Fungicide K 99-5278C
Peak:m/z	Relative Intensity
162.9540100	0.02
166.9277649	0.09
171.1456451	0.07
173.1435547	0.19
175.3687592	0.11
176.9512787	0.03
184.8995667	0.03
186.3265839	0.02
187.0753021	0.15
203.1580505	0.05
205.1722107	0.06
207.2583618	0.03
209.1497345	0.10
213.1885071	0.14
221.3187866	0.03
229.2820587	0.07
230.8634644	0.07
241.0875244	0.08
251.2273712	0.12
253.3408356	0.08
255.3354492	4.43
257.2470703	0.35
258.9326172	0.02
266.9730835	0.05
269.3344727	0.05
271.2511597	0.59
273.1683350	43.57
274.1251831	0.03
277.1116333	0.05
283.2969971	0.02
284.7502136	0.25
285.3724976	0.78
287.1785583	0.15
288.0849609	0.04
291.0953979	0.09
301.3681641	0.15
304.6416016	0.05
305.4640503	0.02
309.4539795	0.02
321.3811646	0.02
327.1089478	0.09
331.4502563	0.23
333.1998291	0.02
339.4379272	0.03
342.2860107	0.22
354.3773804	0.06
357.3836060	0.23
366.2728882	0.09
381.3736572	0.37
385.4176636	0.05
393.6129761	0.11
397.6161499	0.08
398.3418579	0.04
399.3466187	1.53
401.3977051	0.31
403.1573486	0.19
406.4763184	0.03
413.3837891	0.18
415.3307495	0.50
417.3126831	100.00
417.9250488	0.42
420.0874634	0.04
425.5343628	0.09
429.5077515	0.03
435.3865356	2.34
441.3127441	0.04
451.6917114	0.05
458.6596680	0.15
461.5595703	0.06
464.4310303	0.02
469.3958130	0.01
471.5044556	0.03
473.2308960	0.09
489.1214600	0.39
491.0167847	0.04
495.3142700	0.02
497.2631226	0.04
503.4577026	0.05
507.0415039	0.14
507.6972046	0.15
513.2885132	0.05
516.4764404	0.02
525.4619751	0.40
533.1771240	0.14
535.1275024	0.14
538.2088623	0.05
540.1635132	0.26
543.4798584	1.78
560.5771484	0.25
561.3601685	1.48
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1097.5397
Annotation	Elephanoside F
Peak:m/z	Relative Intensity
450.6515503	0.01
611.5408936	0.32
612.5989990	0.45
613.4954834	0.25
708.6390991	0.03
736.3930664	0.04
755.5839233	0.05
756.5899048	0.08
757.7376709	0.04
773.5574951	6.24
774.5723877	17.97
775.6326904	7.27
817.6535645	0.02
870.3835449	0.01
882.3299561	0.04
885.1040039	0.04
888.4243164	0.02
917.6939697	0.18
918.5577393	0.52
919.6730957	0.06
931.9158936	0.12
935.7550049	25.33
936.5661621	100.00
937.5097656	45.42
938.4342041	0.01
960.0769043	0.02
997.5749512	0.05
1005.5434570	0.01
1058.3317870	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0855
Annotation	2'-Methoxyflavone
Peak:m/z	Relative Intensity
76.95368958	3.64
80.85032654	2.13
83.03296661	1.11
85.24126434	1.76
90.79870605	4.37
95.08235168	4.52
96.93524933	2.52
102.8568878	4.39
104.7836914	2.64
106.9637756	4.99
115.0975037	1.56
121.0704346	3.30
127.1273041	2.42
128.965332	16.03
133.2044067	2.03
135.1979065	1.86
136.7707062	1.75
139.2446136	2.51
140.8029633	7.02
144.8592987	1.08
146.9380951	5.12
149.0762177	1.66
151.0597229	100.00
152.0523682	10.63
153.1801453	4.63
155.0856171	2.09
161.0387878	3.20
162.9235229	12.00
165.274704	1.15
165.9941254	1.74
167.1402435	4.38
170.0304108	2.06
171.1485443	2.40
174.3315582	1.13
178.505127	5.15
179.1612396	8.18
179.9633484	0.83
180.8581543	3.02
182.0780182	7.54
183.0524139	9.55
183.9926758	8.71
185.3729095	4.25
190.1343842	2.47
192.2037506	1.29
192.8982391	2.18
195.095047	15.75
197.0339813	8.76
199.2539825	6.07
203.3996582	3.42
205.0053253	3.20
207.1347656	13.18
209.2792816	7.49
211.2044983	23.38
212.1755219	1.15
217.0213165	13.26
221.4060822	1.29
225.1466827	22.13
235.1876221	53.25
236.2229767	3.91
236.9300537	1.96
238.1717987	36.82
239.1681519	0.81
253.0779419	80.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	365.2174
Annotation	Unknow
Peak:m/z	Relative Intensity
114.0472260	0.13
148.2342224	0.13
150.1027832	0.04
157.8773804	0.18
159.7695007	0.05
162.1251526	0.11
168.1987610	0.02
171.0726318	0.16
175.3806763	0.03
190.1464539	0.08
192.1100616	0.97
195.2067566	0.03
199.2354126	0.03
200.4426270	0.02
203.0518188	0.03
209.1823120	0.61
210.2304077	0.35
211.2371979	0.12
216.2504730	0.06
220.7140198	0.03
226.2522278	0.42
235.3113708	0.28
242.3128662	0.65
243.3739624	0.53
244.2437744	0.02
245.0931396	0.03
247.1481018	0.31
249.1284485	0.11
250.9927063	0.03
253.1838989	0.55
255.4075317	0.06
257.2550049	0.03
259.2200623	40.57
260.2854309	0.35
262.2436523	0.36
265.2097168	30.45
267.6395874	0.05
268.4018555	0.15
269.3809204	0.03
275.1869202	0.11
277.2336731	56.29
277.8919373	0.37
282.2652588	0.09
285.2912598	3.39
291.1939087	0.03
293.2215576	0.03
299.0471191	0.01
303.2018433	1.58
304.2864990	0.44
305.2157898	0.01
309.2001648	37.39
310.4115906	0.07
311.4570312	0.03
320.0133057	0.37
321.3204956	100.00
323.3190918	0.07
329.3806763	0.08
342.8586731	0.31
343.6950684	0.19
347.1670837	3.80
347.8948059	0.18
356.1572876	0.04
359.3738098	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	397.0089
Annotation	Unknow
Peak:m/z	Relative Intensity
127.0038910	0.15
129.0797882	0.22
136.7597046	0.09
138.2196045	0.07
141.0212097	0.04
143.0616760	0.17
145.1903687	0.15
150.6343689	0.04
154.9139557	0.17
172.9329071	2.13
174.0729218	3.42
176.4930420	0.05
193.0448914	0.12
197.1528320	0.04
199.3366241	0.03
201.0962982	0.20
217.2950287	0.14
231.1737061	0.02
244.9725342	100.00
245.5976868	0.41
246.7736206	0.53
251.2807922	0.02
259.2508240	0.11
277.0303345	0.24
278.9584045	36.18
293.0891724	0.03
323.2409973	0.04
329.3626709	0.02
336.1889954	0.06
337.1730347	0.04
349.7552795	0.05
350.9114380	0.50
352.1362915	0.11
353.2057800	0.15
354.2381287	0.07
367.1107788	0.03
378.1953125	0.08
379.3077087	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	367.1608
Annotation	(2S)-2-Butanol O-[b-D-Apiofuranosyl-(1->6)-b-D-glucopyranoside]
Peak:m/z	Relative Intensity
112.9345169	0.56
113.9050751	0.03
118.9760132	0.27
126.9241714	0.25
142.9712982	0.84
145.1135559	0.23
159.0158081	1.00
161.0197144	9.65
162.9254150	0.74
172.8928528	0.85
173.9801331	0.96
180.9559631	0.04
202.8778076	0.14
204.4213257	0.15
205.1929474	0.13
215.8068390	0.06
221.0647583	100.00
221.6755981	0.10
245.1066895	0.04
247.0237122	0.65
248.1390381	0.17
251.9694824	0.06
259.3794861	0.07
263.2646484	0.04
270.8477173	0.07
275.2325439	0.08
280.0765381	0.62
281.1444092	0.12
285.8436890	0.04
305.5168457	0.09
321.0285034	0.49
323.3098755	0.04
324.0374146	0.04
325.9851379	0.08
331.3218994	0.03
332.5582275	0.08
338.4459229	0.08
349.2729492	0.50
350.3705750	0.36
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	281.16
Annotation	Hexane-1,5-diol 1-O-beta-D-glucopyranoside
Peak:m/z	Relative Intensity
81.9292755	0.07
84.7586899	0.10
86.8268662	0.04
94.9303589	0.07
95.6398773	0.09
96.7491531	0.16
98.1079407	0.36
99.8865509	0.43
100.8699341	0.09
107.9936905	0.58
109.8967438	0.16
111.9788666	10.53
114.0033875	2.72
124.2148514	0.37
126.0553894	0.16
129.8726196	0.89
136.9642944	0.05
140.0119324	0.20
141.9892883	0.45
144.9418335	0.09
148.0633850	0.03
150.0294800	4.86
152.1697693	0.62
157.2405090	0.03
160.0701294	1.79
161.1075745	0.15
166.0333099	0.11
167.1591339	0.49
173.1106415	0.20
175.0848236	1.18
175.8774719	0.12
177.1361694	2.95
178.0945740	1.06
179.0587311	0.19
181.2763367	0.14
192.1580658	15.92
193.1632996	16.88
194.0671997	0.16
195.1168823	0.03
199.2355347	0.10
201.0943604	0.09
202.1788635	1.53
203.1481628	0.11
205.3001404	0.03
207.1403809	1.12
209.1360474	98.77
209.8229980	0.27
218.0892639	1.87
219.1700745	6.70
220.0941467	4.81
221.2094421	1.09
222.2428894	0.13
223.0492249	0.12
224.0756531	0.03
224.9640503	0.04
228.9052429	0.09
235.1529541	47.44
236.0198669	2.94
237.1627197	5.06
238.3164062	0.06
239.2702637	0.64
241.2249756	0.22
245.3484192	0.89
246.1987610	0.71
247.0767822	0.56
250.1715393	0.20
251.2510681	0.19
253.1146851	100.00
257.4204407	0.20
263.1422424	26.61
264.1944885	26.46
264.8778076	0.06
272.2210693	3.58
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	507.1655
Annotation	3'-Hydroxymethylrocaglate
Peak:m/z	Relative Intensity
148.1342773	0.04
149.9327698	0.04
164.2397003	0.11
165.0622864	0.36
176.1201019	0.50
181.2092438	0.05
204.2049561	0.06
254.3269043	0.11
282.6458130	0.04
288.7874146	0.08
295.1450500	0.06
301.9742126	0.10
306.2218018	0.08
312.0669250	3.55
317.0608521	0.16
321.2388306	0.06
323.4992676	0.14
326.2119446	0.24
330.1538696	100.00
330.8260498	0.25
341.3169556	0.32
342.1445618	0.14
361.0796509	0.17
362.0316162	0.05
372.2278137	0.05
373.1161499	0.22
392.0151367	0.03
400.9985352	0.16
419.8018799	0.16
422.9224243	0.05
447.0041199	0.08
466.3088379	0.21
488.1261902	0.29
489.1452332	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	402.07
Annotation	Unknow
Peak:m/z	Relative Intensity
115.9477844	0.10
118.2231369	0.08
132.0981903	0.16
133.9827271	0.09
134.7183533	0.07
136.8528748	0.47
140.5919189	0.13
152.7434235	0.19
154.9331970	0.24
159.5734100	0.16
167.7937012	0.29
169.0749817	0.41
173.2166443	0.09
176.8797913	0.27
180.1622314	0.20
183.1648865	0.09
187.0320587	0.09
191.3697205	0.18
193.1077118	0.13
196.8265228	0.06
201.0899963	0.29
202.8002625	0.07
208.0944672	0.21
209.0560455	0.14
211.0426636	1.05
215.0138855	0.07
218.8861084	0.08
222.3321533	0.06
223.2723541	0.43
224.0484314	0.14
225.9578705	0.11
228.8871460	2.18
231.0951233	0.13
243.3522949	0.05
246.1666565	0.33
246.9203491	0.86
252.2833862	0.39
263.2403870	0.21
267.3069458	0.37
269.2556152	0.39
270.0985107	0.23
275.2536316	0.11
278.3016052	0.32
278.9965820	0.24
283.1857300	0.15
284.8451538	0.10
292.9749146	0.14
295.2209473	0.05
296.2267456	0.89
303.0605469	0.19
306.1938171	0.15
307.1707153	0.14
310.1038818	0.10
311.2712402	0.34
311.9945068	0.11
314.1087036	0.14
317.0256958	0.08
319.0457153	0.50
320.1098022	0.16
322.0310974	0.21
324.4147339	0.11
325.1493530	0.15
327.3065186	0.06
328.0904541	0.08
330.8954468	3.16
333.3307800	0.04
335.0673218	0.17
338.4420776	0.13
339.2352295	0.21
343.0370789	0.31
347.7914124	0.09
348.8570251	2.51
352.8453979	1.38
353.6293030	0.17
356.0000610	0.19
357.3553162	0.18
358.4156799	0.57
359.3092346	0.12
364.9301453	0.18
366.8251953	100.00
367.5043945	0.35
370.1146240	0.76
371.0427551	0.25
373.4599304	0.65
376.2655029	0.95
383.1859436	4.72
384.1706238	5.61
384.8284302	6.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	415.1609
Annotation	Phenylethyl O-alpha-L-arabinopyranosyl-(1->6)-beta-D-glucopyranoside
Peak:m/z	Relative Intensity
123.0540161	0.07
124.8893738	1.74
127.0494385	0.22
128.9447632	0.04
130.8125916	0.07
143.1906128	0.30
143.7971039	0.10
144.9109192	0.19
153.0123901	0.36
159.0612488	1.55
161.0381470	14.85
163.0976410	1.11
175.1059723	0.05
177.1397095	0.05
187.1380005	0.32
209.1159668	0.07
229.0156250	0.05
234.1199951	0.05
247.1057434	0.43
251.1248169	0.49
259.4089050	0.17
269.0713196	100.00
279.3193054	0.21
284.2960205	0.07
285.7138672	0.23
288.9892273	0.46
296.2322693	0.08
307.1712952	1.28
309.0109558	0.10
311.1326904	0.08
326.7257080	0.16
328.2291870	0.49
330.8448486	0.03
367.1203308	0.15
369.0274353	0.53
380.1416931	0.07
397.0572815	0.52
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1213.585
Annotation	Uttroside B
Peak:m/z	Relative Intensity
595.6158447	0.21
719.5405884	0.04
737.7249756	0.02
739.6694946	0.10
742.6449585	0.02
743.8098145	0.03
757.5393066	11.61
758.2221069	0.05
777.6495361	0.03
837.6737061	0.12
847.4145508	0.04
853.6331787	0.50
865.6237793	0.29
887.6403809	0.02
889.6948242	0.27
901.7298584	0.37
905.7640381	0.02
919.5490723	26.88
920.1777344	0.20
939.7150879	0.04
961.2980957	0.07
1049.4265140	0.03
1051.5533450	68.31
1052.2531740	0.11
1063.6043700	0.53
1079.5585940	0.06
1081.5031740	100.00
1082.2651370	0.12
1097.0925290	0.01
1107.3806150	0.02
1194.6279300	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	294.12
Annotation	Norfluoxetine
Peak:m/z	Relative Intensity
127.9638214	84.98
129.0462494	50.41
130.7841949	0.12
146.9253235	0.23
164.1329651	2.35
165.1912231	1.49
220.9431458	0.20
257.0666504	0.59
258.2035522	5.60
275.3334961	4.38
276.1584473	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	579.1796
Annotation	Unknow
Peak:m/z	Relative Intensity
171.2409973	0.53
172.1813354	0.05
179.1539612	0.63
180.2456055	0.08
197.2150421	0.38
198.2020874	0.02
215.2638550	0.85
216.2731628	0.07
253.2564240	0.38
254.3185730	0.04
255.0825500	0.00
271.2316589	3.31
272.3154297	0.61
289.1513672	100.00
290.0907593	11.94
291.1873169	0.15
340.6112061	0.00
404.0832520	0.02
417.3693237	0.01
432.2725830	0.01
465.2583008	0.01
478.1850586	0.00
532.9973755	0.00
550.4477539	0.00
560.8627319	0.04
561.9954834	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	305.1157
Annotation	Sterequinone D
Peak:m/z	Relative Intensity
115.7601318	0.33
116.7882690	0.05
120.0344849	0.20
129.9713135	0.05
134.7521057	0.08
135.9391479	0.09
140.3042908	0.06
142.9947205	0.81
144.0728607	3.53
145.0162659	61.98
145.9804688	0.52
152.0989380	0.14
158.0855560	0.06
161.9221344	100.00
164.7985229	0.06
172.2559509	0.04
174.0337219	0.17
176.0712128	0.86
183.9689026	0.06
188.2535248	0.07
194.8932190	0.11
197.0973663	0.06
199.0341797	0.08
202.4324951	0.28
209.2886658	0.09
215.0340271	3.30
216.0365295	0.07
218.0211487	0.37
228.1238098	0.25
230.3857117	0.25
231.2252502	0.14
233.0006104	0.58
233.7937927	0.16
234.9477844	0.12
237.7757874	0.41
239.7705078	0.07
245.2363586	0.41
247.0795593	0.03
248.0528870	0.19
250.2819214	0.08
259.0878296	1.02
259.8511963	0.21
261.1496582	0.91
262.9173584	0.40
263.8904419	0.51
266.2407532	0.05
268.2987061	0.07
269.2821655	0.16
270.1038818	0.19
273.2774048	0.04
275.1576538	0.88
277.3255615	0.78
281.7622070	0.08
282.8960571	0.18
287.0699463	3.50
288.1515503	7.39
291.1095276	0.25
293.1441040	0.09
295.7404480	1.00
296.5544434	0.13
318.0544128	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	397.0089
Annotation	Unknow
Peak:m/z	Relative Intensity
127.1026764	0.05
129.1727753	0.02
134.7698975	0.03
136.8493500	0.04
143.0205841	0.39
151.0640717	0.10
154.8978882	0.03
167.0309906	0.05
169.1466064	0.09
171.8440094	0.05
173.1312256	4.82
173.9678650	7.64
193.2244873	0.09
217.0298615	0.02
227.3877258	0.02
245.0493469	64.80
246.4367981	0.19
247.0791321	1.06
258.9053650	0.14
278.8875122	100.00
279.5103760	0.13
281.2753906	0.02
290.7396240	0.06
309.2178345	0.04
318.7331543	0.02
324.6825256	0.04
335.6093750	0.06
336.4258728	0.04
337.1940002	0.05
351.2127380	0.22
353.4561768	0.05
369.2748718	0.02
378.2326050	0.02
379.4706421	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	307.1397
Annotation	Unknow
Peak:m/z	Relative Intensity
88.9647980	0.23
94.1398392	0.25
95.0740509	0.35
97.2408829	0.09
99.0070953	4.59
100.8820343	3.24
102.6075287	0.15
112.9773254	3.38
115.1116486	0.17
116.8846893	0.07
119.0134277	3.65
122.0156555	2.05
124.9368896	0.17
127.0491943	1.65
128.0306396	0.88
129.0762024	0.82
131.0279541	1.04
136.0795593	1.23
141.0937805	1.56
142.9477234	3.11
145.0094299	100.00
146.0958252	0.11
149.0110779	0.35
150.1264038	0.58
156.9942627	0.21
159.0278320	0.35
160.0094452	0.43
160.9385376	0.53
165.0002136	0.06
166.2503510	0.08
170.8414612	0.13
178.1117249	7.74
179.0571136	0.94
187.2102966	4.96
192.8153534	0.05
199.1176758	1.08
201.1019287	0.15
202.2232361	0.10
209.3214722	0.04
216.9837036	0.49
219.1010742	0.23
220.2735291	0.12
221.2051697	0.28
227.3064880	0.21
231.4230957	0.27
233.1964417	0.23
234.9258118	0.14
243.3527832	0.19
245.1737366	1.36
246.0718384	0.19
246.9979858	0.30
252.7474365	0.09
253.9583740	0.10
255.1229248	0.84
260.9634399	1.42
262.1516113	0.06
263.1219482	0.73
265.1736145	1.10
271.1313477	0.32
272.0008545	0.48
273.1563110	0.12
276.9956055	0.27
279.2753906	0.06
288.2073364	0.85
289.1823120	2.56
290.1443481	0.18
292.1720581	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	354.144
Annotation	Unknow
Peak:m/z	Relative Intensity
105.8394775	0.05
117.2084961	0.09
122.0609665	0.18
123.9604034	0.16
129.9794006	0.03
131.9440002	0.04
133.0674591	0.04
133.9762878	0.03
135.9416809	0.04
146.1321106	0.23
149.9547577	16.37
152.1336365	0.57
154.0574951	0.47
157.0714417	0.03
158.0263672	0.20
159.0451813	0.75
161.3058929	0.03
163.1206360	0.22
167.0700989	0.46
169.0211182	0.11
171.0903015	0.32
173.8404999	0.08
176.1158447	0.02
177.1433105	0.02
178.2098999	0.04
180.9794006	0.12
188.0183563	2.87
189.0810242	0.04
191.2201843	0.06
199.1780396	0.11
202.0969238	0.15
203.2484131	0.58
205.0691681	7.39
207.0914612	0.10
215.0563049	0.22
219.1337891	0.03
225.1325684	3.45
226.1263733	0.06
229.2790222	0.14
232.2003479	0.03
237.1083374	1.91
246.6253662	0.20
247.2762146	0.35
248.0672607	0.29
249.2392883	4.20
250.2630920	0.09
259.7426453	0.02
263.1040039	0.62
264.2395630	0.22
265.1160278	0.13
267.2442017	2.95
272.7413025	0.05
275.1856689	8.20
281.1366272	51.50
282.3255615	0.06
285.3420410	0.03
292.2042236	24.33
293.3013916	17.92
295.4109802	0.23
299.3742676	0.25
304.7789612	0.06
308.1628723	0.54
310.2002563	100.00
311.1030884	0.04
313.0039062	0.14
318.1985474	0.74
319.3292847	0.59
323.0964355	0.08
329.7257690	0.10
332.0531006	0.10
332.7249146	0.34
335.2149353	0.34
336.2389221	4.59
337.1293030	1.47
338.9685059	0.04
345.1556396	0.17
346.2221985	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	357.25
Annotation	13,14-dihydro-15-keto Prostaglandin E1-d4
Peak:m/z	Relative Intensity
157.4995117	0.75
159.0321045	0.74
171.0765076	1.11
173.2323914	2.31
183.1168365	0.35
185.1509705	0.30
187.19841	0.86
199.1207886	1.21
201.0432129	1.82
201.9089813	0.42
203.0964966	1.21
206.8213501	1.41
213.0173492	1.08
215.1783142	6.14
224.9145813	0.45
227.3370361	1.66
229.1160889	1.99
231.1629944	0.34
240.9704895	0.74
243.3181763	5.83
245.0108032	1.55
251.5612183	0.30
255.1841431	3.90
257.0699768	2.14
259.0610962	2.68
260.2990723	0.58
263.3521729	0.96
264.9246216	1.15
269.3291016	1.15
271.3229675	4.66
273.3877258	0.95
277.1491699	0.34
283.2818298	1.57
285.3506165	6.55
287.4285889	0.89
291.2357788	0.37
295.0447693	1.37
297.334198	3.03
299.2588806	5.46
301.31604	2.30
309.5007019	0.62
310.6156311	5.52
311.3825378	0.95
312.1879578	0.93
313.1036987	3.49
315.1278076	2.94
321.1385498	3.02
323.3026428	9.34
325.2738647	1.98
329.2421875	0.76
332.82724	0.59
339.2520142	100.00
339.9625244	0.43
341.2545471	13.12
355.0899048	0.70
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	291.1001
Annotation	N-gamma-Glutamyl-S-allylcysteine
Peak:m/z	Relative Intensity
83.8276825	0.02
115.8555145	0.89
116.8733063	0.05
119.9969940	0.17
130.0409393	0.65
144.9234772	61.83
148.0219727	0.30
161.9420166	100.00
182.2959595	0.02
204.8980713	0.05
217.1525269	0.11
228.0139465	1.98
231.3287964	0.07
244.6198425	0.19
246.3404541	0.06
249.2275391	0.24
255.0201416	0.17
273.0731506	0.99
274.1839294	8.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	925.2452
Annotation	Unknow
Peak:m/z	Relative Intensity
340.9870911	0.23
383.2931213	0.50
395.2996216	0.05
403.0463257	0.17
410.6334839	0.03
413.1689453	0.03
425.1987305	0.06
442.9874268	0.27
485.0906372	0.02
503.1217041	0.56
545.3255615	1.14
565.1204224	0.04
574.9364014	0.02
583.4770508	0.32
601.2163086	0.78
605.1780396	0.17
647.3437500	0.48
665.2379150	0.45
745.3051147	0.15
763.2332153	1.25
763.8547974	0.04
827.2521362	100.00
827.9251099	0.20
907.2427368	8.90
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	478.2939
Annotation	PC(15:1(9Z)/0:0)
Peak:m/z	Relative Intensity
152.5576935	0.05
168.0646820	0.08
171.2241211	0.17
196.1573792	0.30
208.0287476	0.11
209.0970612	0.32
210.8780365	0.03
214.0376282	1.46
242.9700317	0.10
254.0202332	0.06
266.2297058	0.05
273.9080200	0.07
281.2847595	100.00
281.9206543	0.11
299.8896484	0.15
323.2401123	0.08
327.3564148	0.06
351.0690613	0.30
352.4955444	0.10
370.3242188	0.05
379.1492615	0.11
393.0814514	0.13
402.1632080	0.12
404.1306152	0.14
407.2384338	0.09
432.0009155	0.06
433.9795532	0.09
442.3169250	0.14
447.3774109	0.05
459.4276428	0.56
460.2950134	0.38
461.0761414	0.21
461.7097473	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	285.1456
Annotation	Abacavir
Peak:m/z	Relative Intensity
110.9183350	0.05
127.9215851	100.00
128.7084656	0.05
133.1482849	0.12
139.1625977	0.11
143.4001160	0.08
156.1396790	2.20
161.1280365	0.09
163.1869812	0.16
164.2880554	0.09
191.0209961	0.12
197.2594910	0.21
202.2188721	0.26
204.9819031	0.13
223.2157593	0.21
225.0428162	0.12
226.8329468	0.03
227.9189148	0.12
239.1875000	0.33
240.9197693	1.10
241.9742432	0.11
243.1903687	0.09
249.2458801	4.12
255.2500000	0.10
256.1458740	0.06
267.1392212	68.07
267.7560425	0.09
270.0827026	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	355.22
Annotation	Unknow
Peak:m/z	Relative Intensity
109.9310150	1.12
115.0858078	0.08
118.4113770	0.03
119.9816971	0.07
121.9882889	0.05
123.1647644	0.86
124.0615845	2.96
142.1249084	0.32
145.0961914	0.16
149.0088806	0.18
150.1937714	0.09
156.1701965	0.02
159.0659180	0.39
160.0190735	0.05
166.4662628	0.32
167.1337891	0.43
185.2285614	0.14
190.1427917	0.09
192.1199036	0.10
193.0221558	0.03
195.9539490	0.23
200.9447937	0.14
203.1823425	0.11
204.9010010	0.06
208.1399536	0.09
209.2475281	0.10
211.1757202	0.05
215.0685425	0.46
216.1743164	0.04
217.3887634	0.09
219.0331421	0.05
221.1380920	0.19
224.7421570	0.03
225.3930359	0.03
226.1998596	0.30
227.0297852	0.07
228.2995300	0.15
232.5472412	0.05
234.1690674	0.05
249.1025391	1.46
250.1503906	0.20
250.9335022	0.13
253.2218933	0.35
253.9375000	0.02
257.1041260	0.13
263.7328186	0.14
265.2208252	0.19
267.4116821	0.12
268.1142578	0.05
273.9375916	0.12
275.1393738	0.22
278.9285889	0.04
280.2826843	0.35
281.2064209	0.36
282.1353455	0.31
283.4685669	0.29
285.2492371	0.08
287.4770813	0.07
291.1565247	0.21
293.4113464	2.78
294.2008057	0.31
295.3881226	0.18
298.9680176	0.21
301.3253784	0.09
304.3600464	0.14
307.5934448	0.22
309.1524353	0.48
310.3621826	0.06
311.2570801	1.23
313.4559631	0.05
314.0877991	1.53
319.1116028	0.19
319.8128967	0.13
321.1215515	0.36
322.8198242	0.56
324.0701294	0.05
325.1120605	0.10
327.2828369	0.18
331.7281494	0.14
332.7595520	0.15
337.2277222	100.00
337.9430542	0.82
339.9595337	0.09
340.6508179	0.07
341.3415527	0.13
345.9693909	0.10
346.8314514	0.31
353.5354919	0.03
355.3994446	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	567.2111
Annotation	Unknow
Peak:m/z	Relative Intensity
168.0352325	0.04
185.2136841	0.14
209.2196503	0.12
225.0732574	0.06
231.1427002	0.60
232.3075256	0.16
237.1994019	0.05
242.2472992	0.17
242.9300537	0.11
249.3615112	0.15
256.2434082	0.04
258.1729431	0.03
259.6446838	0.13
260.4017944	0.20
273.9385986	0.34
277.1818848	4.49
278.1553955	0.72
279.1155396	0.03
279.9884033	0.05
284.1271973	0.25
291.1242065	6.76
292.2514648	1.72
295.1797180	0.26
296.3482666	0.08
316.2951660	0.04
317.2040405	0.06
319.0885620	0.04
320.3632202	0.03
327.7052002	0.05
328.3229980	0.15
341.2050781	0.07
347.1243896	0.03
357.6682739	0.02
360.9147339	0.09
362.0751343	0.06
364.3536987	0.04
365.1043091	0.02
372.2650146	0.08
378.2984009	0.04
379.2579956	0.06
380.0561523	0.08
384.8681641	0.03
386.3696899	0.07
388.2266846	0.03
391.1682739	0.09
392.4966431	0.07
396.0351562	0.06
398.1754150	0.02
400.8975220	0.12
402.0787964	0.72
403.0951538	0.30
405.2407837	0.39
406.2398071	0.22
407.2863770	0.21
420.1998291	0.72
421.0656128	0.11
422.0848999	0.08
433.4310913	0.05
435.3049927	0.02
436.3777466	0.09
438.1889648	100.00
439.2489014	25.33
457.5186157	0.02
469.5345459	0.04
475.5754395	0.07
476.3022461	0.02
477.7020264	0.18
478.6694336	0.13
482.4485474	0.06
487.6044312	0.36
494.2238159	0.13
504.2243652	0.33
504.9079590	0.04
505.5839844	0.09
522.2350464	0.25
526.3848877	0.11
532.1522827	0.52
536.3102417	0.03
542.6353149	0.32
549.3666992	2.93
550.3088989	2.29
551.2727051	0.05
559.2982788	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	619.1741
Annotation	Unknow
Peak:m/z	Relative Intensity
179.0218201	0.29
221.0965271	0.13
233.2392578	0.03
241.1399231	0.20
249.8735657	0.06
250.7264404	0.15
258.9698181	0.12
263.1827087	0.03
276.0372925	0.14
277.0959167	2.89
280.6984253	0.09
295.0992432	0.06
309.0886230	0.09
323.1209717	0.43
341.1503906	0.46
363.1886597	0.09
383.3266602	0.19
442.0747681	0.25
457.3863525	0.25
503.2537231	100.00
503.8790283	0.25
543.6921997	0.37
573.5264282	0.49
577.4605103	0.05
601.2352905	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	444.1313
Annotation	Propaquizafop
Peak:m/z	Relative Intensity
162.1494751	0.27
171.1557312	0.09
183.2566528	0.10
190.0464325	0.28
208.0979614	0.60
221.0760803	0.24
227.2000122	0.08
232.1751099	0.22
236.9177551	0.05
239.3050537	0.21
255.2284241	0.16
264.1422729	0.44
267.3271179	0.59
268.1954346	0.88
269.2861328	0.09
271.1289978	0.16
282.3209534	0.28
283.0765991	0.20
294.9981079	0.17
295.9933472	0.23
297.4248047	0.18
307.3374634	0.20
311.2270813	0.11
321.8609619	0.06
327.0239258	0.50
336.4909363	0.16
338.1026001	0.10
339.0409546	0.31
345.2829590	0.05
346.3363647	0.19
348.4014893	0.17
354.1780090	100.00
355.2826538	0.07
359.0206909	0.29
362.9365845	0.35
369.1551514	0.37
376.0575867	0.14
380.2126160	0.38
385.1252747	0.10
391.0186462	0.24
397.9638062	0.14
401.0423584	0.10
403.0484619	0.12
408.3933105	0.65
409.1018372	0.12
412.7170410	0.93
416.2587891	0.33
425.5780334	0.48
426.1966248	1.76
427.0930481	0.64
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	315.2541
Annotation	12,18-dihydroxystearic acid
Peak:m/z	Relative Intensity
92.62800598	0.34
154.9088135	0.39
162.0733185	0.24
182.9062653	0.39
184.1526489	0.63
189.4066467	1.56
196.8917389	0.24
198.3926392	0.41
217.4358521	0.55
223.3928528	1.72
227.0856934	1.01
230.2869568	0.91
241.229126	0.35
243.4335938	0.38
249.2302246	0.31
253.2835693	38.31
254.5898743	1.90
255.4258728	1.34
256.2283936	0.67
259.2254028	1.29
268.8245544	1.78
270.1900024	1.84
270.8939209	1.78
281.0083008	0.83
297.2395935	100.00
297.9974365	1.97
299.2067871	1.14
300.1872559	0.99
301.0330505	0.46
316.1156006	0.93
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2418
Annotation	Moniliforminol A
Peak:m/z	Relative Intensity
90.87543488	0.09
95.02352905	0.45
96.95516205	0.48
98.75561523	0.43
106.9217224	0.16
108.9974747	1.37
110.8255997	1.18
112.9787445	0.27
122.936882	1.62
124.9141693	0.34
133.2238007	0.44
135.1570435	0.26
138.988739	5.31
142.7629547	0.39
149.3472595	0.36
153.0231476	2.67
155.2422638	0.22
159.0220337	0.75
164.97995	0.34
166.9022827	0.83
168.9483185	1.16
175.1956787	0.52
176.9532166	0.42
178.914978	0.92
180.350296	0.42
181.3322754	0.29
183.278717	0.27
185.1152344	0.23
191.223114	0.15
195.2546997	0.21
197.0798492	4.88
198.1181641	0.43
199.1043396	0.31
203.2091675	2.42
205.2648926	0.14
208.9148865	0.70
211.0968628	0.66
213.4642029	0.40
215.0868835	1.23
221.1926575	2.30
223.04422	1.89
225.1988525	1.01
228.3144836	0.18
231.2676392	0.55
233.401062	0.58
235.2674255	0.12
237.0311584	2.20
239.2000122	13.19
241.4330444	0.49
243.1175232	2.44
251.1332703	1.12
253.180542	0.55
255.3260498	2.67
256.397583	0.70
257.2790527	0.31
259.1501465	0.57
261.2885437	3.78
262.3559265	0.14
269.2988586	0.27
279.2313843	100.00
280.2757568	1.75
281.0536804	0.58
288.8461914	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2415
Annotation	18-Hydroxyoctadeca-9Z,12Z-dienoic acid
Peak:m/z	Relative Intensity
78.98007965	0.52
84.82952118	0.14
90.94226837	0.53
94.80870819	0.85
97.19750977	0.14
99.02853394	0.40
109.1096497	3.17
112.7755051	0.33
119.1544342	0.24
123.0166473	2.37
124.793335	0.27
129.0747986	0.15
131.053009	0.42
134.8731689	0.54
135.8825989	0.20
136.9111938	0.76
139.0765076	2.59
141.1648407	0.40
147.2279968	0.57
148.0857239	0.95
149.2164001	0.50
151.0620728	2.44
152.7596588	1.51
155.1297302	0.98
157.0176697	0.54
159.0658722	0.38
164.7618866	0.11
166.0683594	1.01
166.9746552	1.72
168.3799591	1.09
169.2007751	0.54
178.964447	0.87
181.1712494	0.65
183.2052307	1.79
185.2149658	0.39
189.2732544	0.78
191.0700684	0.70
193.1258392	0.26
194.1190643	0.20
195.0902405	2.80
197.097229	5.31
198.1311646	0.29
198.8937378	0.15
201.106781	0.35
203.1270142	1.43
204.2240906	0.12
205.1634216	1.89
206.2365417	0.45
207.2144775	0.54
209.053833	1.40
210.9844971	2.94
212.9795227	1.13
217.2251892	0.24
219.2147217	4.58
221.2858582	1.68
223.3135986	0.54
225.1751099	3.23
233.0806274	3.94
234.1391296	0.79
237.1558838	2.61
239.1865234	8.82
241.1719666	0.27
243.2086792	1.53
251.1790771	7.01
253.4238281	0.75
255.1560059	2.04
256.0965271	1.40
257.2357178	0.97
261.1331787	6.86
269.2531738	0.71
275.1730042	1.00
277.0835571	0.25
279.2284546	100.00
280.2181702	0.34
281.2307129	4.52
288.3737183	0.73
298.2606812	0.71
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	639.1566
Annotation	Nervilifordin C
Peak:m/z	Relative Intensity
179.0148315	0.14
188.8018494	0.07
190.1522217	0.08
191.0229187	0.05
210.2217102	0.10
214.1546173	0.26
226.2623596	0.20
227.0909271	0.11
235.3590698	0.11
243.1814880	0.37
254.1407318	0.53
255.0888977	3.16
255.7351227	0.04
259.1224365	1.04
271.1290894	6.48
272.0487671	1.48
283.1301270	0.05
287.1928711	0.39
300.0617065	18.80
301.1947021	0.09
313.1299438	0.47
315.1893311	100.00
316.1248779	0.35
317.2392578	0.15
318.2445068	0.03
325.0170288	0.06
328.2205505	0.05
329.2023926	0.10
330.1889648	0.32
343.1992188	0.24
356.1406250	0.18
357.0366211	0.54
360.3008423	0.08
367.3418579	0.09
369.3273926	0.03
375.3369751	0.06
386.7766113	0.17
389.0059204	0.11
404.4432983	0.14
407.4218750	0.03
439.4645386	0.10
446.3449097	0.05
468.0272217	0.08
477.4089355	0.10
479.5209961	0.07
501.2305298	0.10
505.9274292	0.20
509.4078979	0.16
510.7710571	0.07
511.3833618	0.14
518.3047485	0.09
533.4674683	0.11
536.4265137	0.18
537.4069824	0.09
543.7382202	0.05
547.3612671	0.34
557.0924072	0.07
558.7240601	0.32
561.2753906	0.04
562.4365845	0.25
567.6785278	0.07
575.4685669	0.14
576.7062988	0.03
579.3884888	0.04
580.2072144	0.07
592.9821167	0.28
595.3096313	0.96
595.9835815	0.14
597.3477173	0.96
598.5581665	0.13
602.1868896	0.11
607.2863159	0.35
608.3113403	0.05
609.4475098	0.03
611.4824829	0.12
616.3380737	0.20
619.2914429	0.03
620.2362061	0.27
621.3058472	0.59
624.4193115	0.10
636.8786011	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	299.0771
Annotation	Pseudolaroside A
Peak:m/z	Relative Intensity
92.92808533	7.17
93.90989685	1.32
103.1107483	0.84
137.0174866	100.00
137.9519958	90.87
163.9425659	1.58
165.2206116	0.48
166.0448914	4.73
178.8710327	0.94
179.7894897	0.69
184.9755249	3.86
194.2997742	1.50
208.0977173	2.03
210.1911926	7.49
213.1025696	2.80
228.2834167	1.66
240.1014404	9.41
254.1480408	9.61
256.2208252	8.66
258.1004028	1.09
281.3836365	0.69
282.2560425	2.81
282.9639893	2.74
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	337.041
Annotation	Chloropropylate
Peak:m/z	Relative Intensity
103.8426285	0.19
112.7228546	0.06
114.9021835	0.10
128.0213470	0.38
143.0727539	0.92
143.7649689	0.02
145.2277832	0.05
146.8141785	2.72
155.9106445	0.06
160.0384064	0.24
170.2675781	0.10
175.0600586	0.03
179.1412659	0.07
185.1601868	0.04
190.7912750	1.12
207.9040833	0.21
210.1286621	0.44
215.2948914	0.02
228.1085815	10.47
241.0692139	0.18
248.8656921	0.10
254.1620483	8.77
259.1163330	0.17
260.2267456	0.02
272.1473694	100.00
275.1414185	0.28
285.0332947	0.28
285.8403625	0.46
293.0158081	2.95
293.6284180	0.08
294.3482056	0.08
304.1260376	4.35
304.7506714	0.01
319.1247253	9.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	296.04
Annotation	Unknow
Peak:m/z	Relative Intensity
94.0659637	0.15
99.8621674	0.88
103.0153046	0.23
107.9894638	4.07
111.9903107	0.07
115.1369629	0.23
118.9715805	1.26
119.9627228	6.58
121.0072327	1.11
121.9393692	0.35
125.9722595	82.00
130.2602692	0.11
130.9938965	0.09
139.1959534	0.08
147.2160645	0.39
152.1437683	0.15
157.9956055	0.28
162.2027740	0.10
163.1669922	0.34
164.1592102	0.29
166.0207520	40.17
166.9926758	12.13
169.0918427	0.31
171.8162842	0.23
173.2460632	0.07
178.8536377	0.45
182.3046417	0.75
183.9165039	0.16
188.1470642	0.56
190.0212708	2.71
191.3555450	0.12
192.1392212	0.12
200.0172424	0.08
204.1672974	0.13
206.0137024	1.80
210.1729736	0.35
215.8846741	100.00
216.5633240	0.57
221.1254883	0.15
222.2679138	2.17
223.1488953	1.46
224.0795593	2.40
225.9122009	0.07
228.0368042	0.14
230.1151428	0.26
232.0581055	0.81
233.0448303	0.07
234.1092224	0.31
235.2588196	0.29
236.1855164	0.10
236.9460144	0.57
238.1200256	0.64
242.0996094	0.63
243.0635986	0.25
244.0558167	0.13
248.1065063	0.08
249.5602417	1.77
250.4183044	1.62
251.4116211	0.92
252.2435303	0.42
254.2492676	0.67
255.1915894	0.25
259.2354736	0.53
260.1843567	0.84
262.3960571	0.33
263.0715332	1.25
263.7455139	0.22
265.0162964	0.50
267.2364807	0.47
267.9515686	0.25
273.1733704	0.93
275.4005737	0.28
277.2126770	2.31
278.1591187	7.48
279.1764526	1.37
281.2271118	0.18
286.7951660	0.34
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1333.84
Annotation	Unknow
Peak:m/z	Relative Intensity
376.3042603	0.06
433.9161377	0.03
436.2955017	0.03
437.3699951	0.07
447.4373169	0.09
448.3664856	0.10
465.0006104	0.04
488.3408203	0.12
490.5105591	0.13
497.0225830	0.13
522.5424805	0.02
539.3149414	0.07
552.2648315	0.04
556.2730103	0.15
579.9234619	0.03
596.2330933	0.13
600.1889038	0.04
602.8669434	0.10
611.3353271	0.09
612.6060791	0.07
613.3674927	0.01
619.0812988	0.18
627.3380127	0.07
637.6312256	0.18
654.1765137	0.04
658.7097168	0.18
668.4237671	0.95
669.5241699	0.49
671.4616699	0.03
690.8920898	0.10
705.6477661	0.06
708.3184204	0.29
709.2476196	0.04
713.0879517	0.07
725.0390625	0.26
725.9210205	0.05
728.6140747	0.08
734.3713379	0.02
737.6276855	0.05
744.3419189	0.17
751.1794434	0.24
764.3513184	0.07
769.3985596	0.05
770.1456909	0.24
773.5401611	0.08
777.1987305	0.06
782.4609375	0.07
783.5303955	0.11
785.1121216	0.02
786.5665283	0.12
796.7095337	0.16
801.0942383	0.10
803.1965332	0.02
816.5462646	0.05
822.4299316	0.16
839.3430176	0.19
840.2070923	0.32
851.2798462	0.29
861.3757324	0.03
862.3519287	0.17
863.0900879	0.03
867.7768555	0.22
868.3905029	0.17
871.7607422	0.05
874.8145752	0.19
883.1807861	0.34
884.1352539	0.33
885.2425537	0.04
886.3613281	0.03
887.5467529	0.05
888.8536377	0.06
890.5100098	0.18
892.4840088	0.32
901.2572021	0.14
902.5091553	0.20
906.5567627	0.22
908.5767822	0.05
915.1490479	0.12
917.1862793	0.02
922.5876465	0.33
924.2050781	0.30
931.4510498	0.17
933.4244385	0.33
939.1733398	0.11
940.0767822	0.05
940.9704590	0.03
942.3654785	0.05
943.9351807	0.15
950.0102539	0.24
960.2539062	0.04
968.2646484	0.11
969.9003906	0.45
971.3088379	0.10
976.5646973	0.25
978.6828613	0.22
979.3525391	0.73
980.5656738	0.13
983.3166504	0.06
986.5218506	0.34
991.3967285	0.05
992.7895508	0.05
996.4558105	0.07
998.2506104	0.09
1000.4406740	0.05
1001.0661620	0.06
1002.4979250	0.10
1007.5825200	0.17
1008.2963870	0.10
1012.0335690	0.29
1014.5028080	0.81
1015.3780520	0.34
1016.3450930	0.35
1020.7442630	0.18
1026.0369870	0.02
1032.6097410	0.06
1034.9753420	0.09
1036.7526860	0.28
1040.4003910	0.02
1043.1210940	0.08
1044.2918700	0.08
1047.0551760	0.03
1049.1770020	0.11
1051.9655760	0.11
1054.2651370	0.02
1056.0634770	0.12
1059.8442380	0.16
1063.1054690	0.05
1065.2602540	0.16
1069.8322750	0.32
1070.8701170	0.07
1088.1530760	0.15
1093.7736820	0.65
1094.4669190	0.12
1098.2993160	0.15
1104.8767090	0.14
1106.8837890	0.39
1108.2081300	0.11
1109.1304930	0.04
1112.9655760	0.10
1114.8035890	0.27
1118.4675290	0.14
1124.9798580	0.48
1126.4255370	0.16
1127.2879640	0.17
1129.8664550	0.05
1131.0399170	0.10
1133.8720700	0.18
1135.1915280	0.02
1138.2102050	0.16
1140.4973140	0.18
1141.2370610	0.17
1142.5524900	0.23
1143.4860840	0.06
1144.5653080	0.75
1145.4167480	0.08
1146.2091060	0.82
1147.0131840	0.05
1149.6613770	0.45
1150.8509520	0.35
1151.5771480	0.14
1156.4631350	0.14
1161.3798830	0.29
1162.0095210	0.19
1164.2960210	0.09
1165.8942870	0.68
1166.9744870	0.70
1167.5975340	0.27
1169.4157710	0.30
1170.1226810	0.10
1170.8127440	0.35
1171.9096680	0.81
1173.0462650	0.40
1174.6782230	0.16
1175.3620610	0.13
1177.2410890	0.32
1178.0925290	0.23
1178.7189940	0.22
1180.5493160	0.04
1181.1883540	0.25
1182.4541020	0.11
1186.0524900	1.17
1186.9252930	2.78
1187.7229000	2.03
1188.9444580	0.04
1190.3812260	0.04
1192.4453120	0.25
1194.2738040	0.82
1195.4492190	0.04
1199.0472410	0.06
1200.0579830	0.04
1201.2320560	0.33
1202.9942630	11.20
1203.8444820	2.12
1205.0057370	0.09
1206.6538090	2.88
1207.4935300	1.59
1208.4000240	0.27
1210.0590820	0.51
1211.2070310	0.83
1212.9598390	0.60
1213.9213870	1.10
1214.7523190	1.35
1215.8843990	0.10
1217.8974610	0.58
1219.0192870	9.38
1219.9951170	1.46
1222.0764160	1.97
1223.1506350	9.91
1223.8933110	2.97
1224.5979000	0.59
1226.4201660	0.28
1227.2872310	0.71
1228.1054690	0.68
1228.9848630	0.29
1230.9106450	0.77
1231.5246580	0.05
1234.7113040	0.09
1235.4028320	0.19
1238.7194820	0.23
1239.6816410	1.06
1240.5449220	3.15
1241.9545900	0.51
1243.0649410	0.53
1244.0692140	3.38
1244.9997560	0.59
1246.1547850	0.08
1249.4990230	0.08
1250.2675780	0.42
1251.0479740	1.80
1251.7183840	0.66
1252.4967040	0.62
1253.5389400	0.13
1256.0451660	0.11
1258.1588130	0.47
1259.7456050	25.75
1260.5703120	29.21
1261.6586910	0.27
1262.3741460	0.36
1263.7070310	0.51
1264.3876950	0.33
1267.1257320	4.16
1267.9167480	5.54
1268.9296880	0.35
1269.5947270	0.18
1270.6977540	1.18
1271.3287350	2.79
1271.9996340	1.72
1272.6070560	0.14
1273.3168950	0.05
1276.0151370	100.00
1276.9296880	14.62
1277.8026120	0.50
1278.9864500	1.38
1280.1033940	18.41
1280.9453120	3.56
1284.0415040	0.40
1284.8885500	0.20
1287.9222410	0.30
1288.5942380	0.79
1289.4138180	0.09
1291.4680180	0.76
1292.1723630	1.61
1293.0686040	0.76
1294.7446290	0.06
1296.7377930	7.11
1297.4646000	6.06
1298.4423830	0.34
1299.9056400	0.11
1300.5179440	0.43
1301.3193360	0.07
1302.7446290	0.09
1305.7963870	0.21
1306.9213870	0.47
1309.0944820	0.29
1309.9799800	0.13
1311.1464840	0.06
1314.9805910	0.73
1315.5986330	0.32
1316.4665530	0.07
1317.3134770	0.04
1318.4797360	0.37
1319.6945800	0.11
1323.9521480	0.29
1326.0300290	0.15
1337.5537110	0.11
1347.5008540	0.05
1360.0817870	0.23
1378.6822510	0.08
1381.6126710	0.03
1385.1925050	0.07
1386.7471920	0.28
1388.6199950	0.11
1402.2132570	0.09
1405.9312740	0.17
1406.5794680	0.26
1421.5028080	0.02
1432.1763920	0.07
1437.7877200	0.07
1454.3973390	0.11
1456.9158940	0.05
1459.9508060	0.02
1468.4504390	0.07
1470.1606450	0.05
1475.4187010	0.09
1485.3248290	0.07
1486.5655520	0.06
1488.1226810	0.09
1488.8929440	0.08
1492.6682130	0.12
1493.6380620	0.07
1498.7821040	0.14
1502.9155270	0.16
1505.5949710	0.11
1509.3387450	0.09
1518.0212400	0.05
1522.3631590	0.02
1524.1431880	0.08
1530.1918950	0.11
1531.7222900	0.09
1543.7401120	0.02
1548.6044920	0.32
1549.2994380	0.08
1550.4903560	0.22
1591.6983640	0.10
1596.5850830	0.09
1605.4060060	0.15
1634.2137450	0.11
1641.2540280	0.14
1646.3868410	0.05
1666.1058350	0.14
1668.7773440	0.04
1669.5407710	0.11
1683.4335940	0.11
1691.6132810	0.03
1705.5076900	0.15
1711.4991460	0.08
1712.1722410	0.04
1718.4786380	0.10
1719.5223390	0.21
1721.8444820	0.08
1762.4083250	0.04
1763.5592040	0.06
1767.4553220	0.06
1769.9377440	0.23
1775.6667480	0.02
1777.8273930	0.12
1781.4396970	0.03
1782.5487060	0.29
1783.5461430	0.13
1784.2227780	0.12
1788.0106200	0.09
1789.6256100	0.05
1807.0456540	0.16
1809.3277590	0.38
1810.4517820	0.04
1826.4909670	0.20
1833.7440190	0.09
1843.6488040	0.05
1846.8016360	0.10
1850.4392090	0.04
1851.5303960	0.31
1852.2037350	0.03
1856.3001710	0.05
1876.6594240	0.04
1882.1424560	0.23
1882.9466550	0.35
1884.3377690	0.18
1887.9244380	0.04
1890.4357910	0.22
1921.7152100	0.08
1938.5555420	0.11
1940.4147950	0.07
1948.4854740	0.06
1956.3664550	0.09
1957.3760990	0.06
1958.5035400	0.27
1978.4451900	0.12
1980.6578370	0.24
1983.7698970	0.09
1995.8059080	0.05
1997.0606690	0.59
1997.7473140	0.51
1998.6024170	0.68
1999.5430910	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	322.0925
Annotation	Furomegistine I
Peak:m/z	Relative Intensity
94.9761963	0.19
101.1456604	0.14
102.7252502	0.13
106.0684586	0.06
107.8208923	0.40
110.8246460	0.51
122.8386765	0.21
125.9293442	3.90
127.2393799	0.11
128.4237976	0.09
130.0309753	0.30
137.0356445	0.09
141.2375946	0.15
144.0259399	0.24
144.9203796	1.06
149.2526245	0.33
153.0473633	0.06
154.0400085	0.23
155.0577698	0.11
156.0467529	0.05
158.0017395	0.31
161.1145782	0.04
167.1715393	0.07
168.2491913	0.10
170.0845032	5.24
171.1894836	2.37
172.0699463	69.43
173.0169525	0.53
174.0193329	0.39
176.0009308	40.55
177.1476593	1.62
178.1084290	0.20
178.8784790	0.16
180.3052826	0.26
184.9543152	0.17
188.0878906	0.27
190.1127777	0.57
190.8767548	0.16
193.1062927	0.04
198.0541992	0.99
199.9355011	0.13
201.9807739	1.40
203.1735840	0.04
204.0922852	1.23
206.1277466	0.38
208.0872803	0.08
209.0820923	0.22
211.4126282	0.48
214.0505981	2.03
216.0270081	33.79
217.0332642	100.00
220.3723145	0.11
230.2305298	0.69
232.0229797	1.78
233.0210876	0.18
233.9662170	0.29
235.0435791	0.12
235.9974976	0.09
237.0919495	0.22
239.7484436	0.08
240.3700867	0.23
242.2905579	0.32
244.1859131	0.10
248.0600586	6.23
249.1341553	0.15
250.0598145	0.08
251.3997498	0.07
252.1201782	0.13
254.4142456	0.24
257.2941589	0.10
258.1666870	0.16
259.2962036	0.77
260.1533813	0.18
261.3280029	0.31
263.1917725	0.13
265.2172546	0.09
267.2733765	0.06
268.2686157	0.18
271.2189636	0.04
273.2495422	0.12
276.0690002	2.19
277.2180481	0.94
278.1835327	1.14
279.1542358	0.06
281.0487061	20.99
285.1188965	0.13
286.6255188	0.52
287.4346008	0.10
288.1354980	0.19
289.8070679	0.79
291.3472900	0.15
293.6112671	0.08
298.2768555	0.13
299.5426636	0.62
302.0439453	0.35
303.2094116	4.45
304.1643982	2.97
305.1421509	1.40
306.2885132	0.35
312.3273926	0.48
313.2208557	0.72
321.8118286	0.07
327.6285400	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	248.5475
Annotation	Unknow
Peak:m/z	Relative Intensity
72.8479919	0.29
79.0265656	0.44
92.9846039	0.13
96.8808746	3.37
99.0492096	0.16
100.9597321	0.24
102.8647003	0.15
103.6852417	0.45
104.9443207	0.33
106.9415283	0.23
109.8418579	2.27
111.0228882	0.45
112.8725128	3.86
114.7624054	0.26
116.6282959	0.20
118.9976807	0.05
123.2113190	0.08
127.2250671	0.16
128.9530792	7.88
130.0829620	0.23
130.9333344	0.30
133.4570007	0.13
134.2736359	0.19
135.1783600	0.36
136.8225555	21.69
138.9614105	0.27
140.0045319	0.39
142.0578918	1.27
142.9664459	1.17
144.0429230	0.70
145.0752106	0.17
146.1269379	0.08
151.1436310	0.14
153.0718231	0.31
154.9303436	0.12
156.0099030	0.58
157.9872284	0.27
158.9023590	0.39
160.8750458	0.94
162.3756561	0.56
163.3116760	0.36
165.0442505	0.98
168.7843933	0.31
170.8385468	2.83
171.5310822	1.19
172.5025177	0.08
173.6910553	0.37
174.9236298	0.77
175.9911041	2.24
177.0201874	3.22
178.3610535	0.17
181.4494324	0.03
185.4862823	0.15
187.0275116	1.29
188.1121674	0.32
189.9299774	0.29
191.1493988	0.34
192.9779358	0.92
195.5169983	2.06
198.8745270	0.40
202.2635193	1.45
203.1395111	1.00
204.1569366	0.12
205.0723572	0.15
206.9880524	0.54
208.0739288	0.12
208.8803864	0.03
211.5691833	3.59
212.2130890	0.30
212.9901581	0.16
216.2285919	0.10
217.0892792	0.27
219.8794708	0.26
221.3242340	0.13
224.3704987	0.11
225.8610382	0.36
227.6800079	0.39
230.0774536	100.00
231.1335602	1.05
232.1201324	0.07
232.9379272	0.48
239.0738525	0.40
242.5485992	0.45
266.9017944	0.69
283.1305542	0.26
295.9572754	0.20
325.7890930	0.11
334.1011658	5.98
340.2469788	0.17
360.3945618	0.04
364.9749451	0.96
368.0590820	0.10
386.3330688	0.05
390.3015442	0.49
392.0999146	0.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	786.2227
Annotation	Unknow
Peak:m/z	Relative Intensity
259.3132935	0.08
534.6949463	0.07
543.0675049	0.19
624.1746216	0.04
705.2562866	0.54
737.3177490	0.09
746.4547729	0.04
754.2390747	0.11
756.4489746	0.17
763.3509521	0.24
769.1462402	0.57
777.3944092	1.59
1231.8419190	0.20
1287.0552980	0.22
1313.1894530	0.30
1357.3269040	0.23
1411.3604740	0.72
1457.5761720	0.16
1475.4016110	100.00
1476.3913570	38.62
1477.0921630	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1101.3096
Annotation	Maltotridecaose
Peak:m/z	Relative Intensity
363.0489502	0.86
381.3099365	0.14
525.2280884	3.71
543.4379272	0.50
687.3068237	7.82
688.1880493	0.28
705.2870483	4.56
849.4316406	12.49
858.5186768	0.51
867.3836670	6.34
868.1745605	0.18
930.6833496	0.38
939.4057617	10.58
1011.4831540	12.23
1020.3815920	100.00
1021.0559080	6.04
1022.3696290	1.36
1023.4304200	0.14
1026.4140620	0.31
1029.2993160	8.62
1030.4755860	0.44
1101.8076170	0.17
1173.4287110	11.89
1191.4771730	10.27
1335.4926760	8.97
1336.3756100	0.71
1353.4837650	13.63
1354.3773190	1.86
1497.4271240	7.46
1498.0935060	0.05
1515.5262450	16.71
1516.2315670	0.18
1516.8848880	0.12
1659.4739990	6.56
1660.9334720	1.48
1677.4857180	19.58
1678.2873540	0.71
1821.4686280	3.62
1822.1859130	0.14
1839.6231690	22.67
1840.5832520	0.48
1983.6931150	3.42
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	555.1055
Annotation	Unknow
Peak:m/z	Relative Intensity
157.1884460	0.14
169.9501495	0.14
176.8555298	0.22
180.2143555	0.11
180.9067535	0.22
184.0187378	0.18
185.1076660	0.77
186.0705261	0.21
187.2211609	0.47
192.9197083	0.62
199.0814362	0.66
202.1201935	0.34
208.8490295	0.53
212.9600220	0.19
214.1671600	0.25
215.9227295	0.15
217.2504578	0.33
219.0336914	0.57
227.5304718	0.09
231.0206451	0.69
233.9116974	0.25
243.1060486	0.30
244.8744659	0.14
249.0870972	0.75
251.1066437	1.57
254.7218170	0.11
256.1138000	0.89
260.0729980	0.15
262.3888245	0.22
263.0502930	0.40
275.2026672	0.34
276.9213867	0.09
280.1988220	0.22
283.0668640	0.68
287.0671997	4.24
287.9879150	2.27
292.3161011	0.59
296.0367737	0.12
300.1702271	0.39
301.7555847	0.11
303.0681152	0.47
305.1365967	21.88
306.1504517	0.34
307.2756348	0.05
309.2211914	0.13
316.1141968	0.87
316.8971558	1.56
319.1400146	1.06
323.0063477	1.72
325.1077881	0.07
328.2640381	1.17
331.1877441	0.22
334.2053833	3.01
335.0177002	0.40
336.2830200	0.25
337.1881104	0.33
338.2028809	0.06
339.9949341	0.06
342.1094360	1.01
342.8831177	0.17
344.5380249	0.27
345.2701416	0.06
346.1856689	0.96
349.1989136	0.15
351.0266113	5.14
352.4734497	0.23
356.0941162	3.96
357.3651733	0.45
358.0531006	0.33
359.6631470	0.65
360.2814331	4.02
361.2052612	0.55
362.1534424	0.22
366.3872070	0.19
367.2664185	0.48
369.0276489	1.21
374.1533813	15.42
377.1674805	0.13
378.1885376	15.93
380.1400146	2.01
380.9101562	0.43
384.1058960	0.19
385.0156860	0.29
385.9560547	0.85
387.0789185	0.17
388.0825806	0.37
389.1588135	1.49
390.9539185	0.27
392.1830444	1.91
395.0205078	0.09
403.3034058	0.15
406.0848389	14.87
407.2108765	1.20
408.1635742	0.29
409.8398438	1.11
412.9547729	0.66
413.7312622	0.51
414.3433228	0.04
414.9932861	0.19
417.1717529	0.42
419.2192383	0.36
420.4436646	0.47
423.9819946	0.19
425.4463501	0.07
429.0583496	0.12
431.3134766	0.21
432.0882568	0.73
432.7056274	0.08
434.1881104	1.10
435.0842285	2.32
436.1351318	0.05
438.0829468	0.86
438.8796997	0.36
440.9348145	0.61
441.8639526	0.48
445.1680298	0.39
446.2595215	0.56
449.1523438	4.84
450.2498779	0.61
452.0863647	11.61
462.0662231	11.07
463.0062866	7.65
464.1303711	1.79
465.1011963	0.38
466.4880371	0.26
467.2109375	0.09
468.3754883	0.41
469.1824951	0.50
471.3366089	0.07
473.5723267	0.10
478.5395508	0.16
480.0159302	100.00
481.1958618	15.16
483.2320557	2.55
485.2474976	0.46
488.9325562	0.54
492.0604858	0.34
498.1829834	0.14
500.4932251	0.06
508.7965088	0.09
511.1858521	0.94
513.1701050	1.06
514.0375977	6.17
514.6765137	0.06
516.8862305	0.16
518.2293091	0.25
519.6659546	1.36
520.2661743	0.67
526.3437500	0.22
528.1973267	0.65
533.1370850	0.28
536.3173218	2.90
537.1590576	5.31
538.0688477	1.90
546.3941040	0.86
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	283.18
Annotation	Manilamine
Peak:m/z	Relative Intensity
84.04902649	0.02
94.27462769	0.02
105.0418854	0.03
108.9849548	0.07
109.9828339	0.04
111.9014282	0.46
113.0124054	0.37
114.8337708	0.02
120.0127563	0.26
121.033905	0.05
125.9679718	0.61
130.0802917	0.07
133.0237122	0.12
135.9878235	0.04
137.5354004	0.07
138.2221222	0.07
149.0856628	0.03
157.0856628	0.04
162.0026855	0.56
175.0878296	0.12
177.1697388	3.66
178.1603699	0.10
179.1567078	0.03
180.0692291	0.32
182.9582214	0.10
195.0450745	0.12
195.9176941	0.12
197.2059021	0.12
205.1856995	7.51
206.2351074	0.01
221.0134888	4.50
222.1047363	2.94
223.1438904	37.99
224.1556396	2.08
225.0621948	0.06
237.1877136	0.26
239.1891174	4.66
240.3264771	0.06
241.2329407	0.24
241.895752	0.01
248.0540771	1.33
249.0486145	0.12
255.1262207	0.03
265.1724243	100.00
266.1752319	6.10
271.1336365	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	453.1979
Annotation	Unknow
Peak:m/z	Relative Intensity
128.9372559	0.08
135.9925232	0.04
137.8720703	0.05
142.1040955	0.18
146.2609558	0.20
148.2080383	0.13
149.1000366	0.26
150.2515564	0.06
158.0281372	0.12
159.2799988	0.37
160.0685730	0.17
161.2489624	0.28
162.0427551	0.19
172.1544952	0.18
173.9583740	0.11
179.0509644	0.06
184.2086334	0.47
185.2365112	0.27
188.2073669	0.47
189.1078491	0.05
191.0867615	0.15
192.1395264	0.16
198.1468964	0.03
199.2481384	0.07
200.2165527	0.30
201.1066284	0.31
202.2584229	0.72
204.2055054	1.62
211.0481873	0.06
214.0856018	0.15
214.9883575	0.49
216.0223999	0.13
219.2013855	0.06
221.0095215	0.06
222.0081024	0.05
223.9582214	0.46
224.5901337	0.16
226.2329712	2.84
227.1212006	0.99
228.2283630	3.84
232.2507324	0.19
233.2268066	0.35
242.2386475	0.61
243.0610657	1.29
244.1140137	0.69
245.2110291	2.12
247.1921692	3.44
248.3119812	0.34
249.2626648	0.33
251.3584290	0.77
257.5964355	0.65
259.1730652	26.88
260.2905884	2.98
261.2360229	0.98
263.4884949	0.22
265.0839539	0.39
266.5971680	0.30
268.2698364	2.48
269.2449341	0.04
274.1043091	0.20
275.2113647	0.07
277.2778015	3.17
278.0967102	0.03
280.1373901	0.05
283.2754211	0.60
285.2132874	39.46
286.3101196	3.03
291.0141907	1.11
293.2933655	0.88
295.7007751	0.10
296.3376465	0.12
298.0727234	0.15
299.8134766	0.12
301.2863770	0.91
302.0529175	0.04
303.2896729	100.00
304.2055054	2.56
309.2990112	0.12
310.1309509	0.10
311.3630371	0.19
312.2092285	0.43
315.1668091	0.33
317.2698059	4.56
318.2510681	0.15
321.3447266	0.91
329.3154297	2.22
330.3356934	0.23
331.8921509	0.06
335.2175293	14.74
337.2904053	0.14
344.0477905	0.16
345.1884460	0.13
347.2972412	6.45
349.2839966	1.18
350.2926636	1.44
352.3399658	0.16
353.3515320	7.53
361.1513672	0.11
362.5211182	0.10
363.3432922	0.06
365.2743530	4.00
368.1190186	6.89
368.7626648	0.04
374.1984863	0.84
375.1687927	0.10
379.1650085	0.75
381.2219238	0.20
381.8911438	0.31
391.3528442	3.55
392.3866577	0.16
394.2292175	0.08
395.2176514	0.06
397.2310181	44.46
407.2856750	0.36
409.2963867	69.15
411.3635559	0.12
412.1384583	3.60
417.1150208	0.12
418.0328674	0.05
435.2802124	5.09
436.2400208	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	605.1565
Annotation	Unknow
Peak:m/z	Relative Intensity
175.0703888	0.27
177.0104980	0.08
193.0377502	0.15
199.8337250	0.09
205.0068054	0.59
210.8777161	0.09
217.0174408	0.06
223.0111084	0.69
235.0426941	0.16
241.2877960	0.15
252.7944794	0.31
258.1243286	0.19
259.0665894	0.54
261.2252197	0.10
270.9796448	2.49
272.0262451	2.52
273.2840576	0.05
279.1889038	0.73
281.0693359	2.18
288.9612122	2.27
290.0608521	0.12
293.0537109	0.07
303.1192017	0.22
306.8768921	0.17
308.9757996	0.26
312.0519409	0.16
324.4169922	0.41
325.0297852	2.21
326.1048584	0.12
330.1273804	0.12
332.9806519	0.22
339.0239868	1.06
343.2069092	0.09
344.2999268	0.19
351.9281616	5.19
353.1858521	22.55
360.8554688	1.93
362.0649414	14.86
363.1245117	0.39
371.1559448	0.15
373.2287598	0.04
378.2432251	0.26
378.9573364	0.10
381.1057739	2.56
381.8135376	0.04
399.0247192	1.64
413.9886475	0.15
424.9674072	0.78
432.9633789	6.63
434.0609741	27.86
434.7993774	0.63
435.5957031	0.17
438.0040894	0.14
439.0303955	0.29
441.9364624	10.04
443.1500854	54.93
444.1692505	1.13
445.2519531	0.22
453.4598389	0.27
458.7414551	0.13
468.7660522	0.04
470.0976562	0.21
471.1124878	0.60
477.1218262	0.26
479.4518433	0.07
494.5346680	0.15
495.3491821	0.03
497.8474121	0.85
498.6944580	0.20
501.2271118	0.13
507.4159546	0.16
510.8626099	0.07
514.3230591	2.13
515.2140503	8.60
517.8123169	0.11
523.2789307	27.71
524.1523438	100.00
525.1692505	2.45
526.4172974	0.91
531.1904907	0.10
539.0488281	0.71
539.9732056	0.16
540.7015381	0.07
541.6620483	0.64
543.0994263	5.16
545.4669189	0.75
552.6408691	0.32
553.4047241	0.47
556.0892944	0.07
558.1766968	0.17
559.1806641	0.28
560.9226685	13.58
561.5275269	0.13
562.2124023	0.23
563.6906738	1.57
565.5511475	0.64
574.8762817	0.54
581.7711792	0.24
587.2753906	0.82
595.1503296	0.22
599.5490112	0.26
602.9979858	0.29
633.1973877	0.06
650.5810547	0.10
687.2555542	0.09
691.5331421	0.46
699.6555786	0.29
701.8806763	0.12
702.8887329	0.63
705.1935425	14.21
706.1492920	0.10
721.0941772	0.91
723.0664673	23.93
723.9926147	0.17
725.2313232	0.10
736.4683228	0.16
765.3500366	0.30
798.1124878	0.46
825.0903931	0.68
854.9147339	0.17
867.1877441	1.23
882.0452271	0.37
883.0184937	0.93
884.6752319	5.06
885.2793579	28.76
886.2844849	0.34
946.2859497	0.11
951.3078003	0.24
952.8173218	0.18
955.3461304	0.23
957.3020630	0.64
987.0840454	0.37
1044.4781490	0.49
1045.3435060	1.44
1046.6970210	7.23
1047.3116460	35.10
1048.2764890	0.24
1064.3734130	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	533.1785
Annotation	4-Hydroxyrottlerin
Peak:m/z	Relative Intensity
165.9407959	0.07
205.8646240	0.35
221.1709900	0.45
225.3251648	0.25
247.2055511	0.63
249.2492065	1.97
252.2410278	0.13
257.1860046	0.06
260.8804321	0.04
263.0940552	19.76
273.0037842	0.55
275.2922974	0.17
281.1320496	0.16
282.1602173	0.14
283.4453125	0.35
287.0247192	0.69
290.3950500	0.86
291.2992554	0.11
297.3262939	0.59
301.2553406	0.15
302.4035645	0.08
306.0999146	0.17
316.4577637	0.30
318.2338867	3.21
320.4902344	0.13
329.2866211	0.26
336.2766113	0.20
341.1627808	0.12
343.9340820	0.09
354.3639526	0.13
356.1588745	0.37
357.8369751	0.53
359.5545044	0.62
361.1478882	100.00
369.0764771	0.08
370.1260376	0.29
387.0537109	1.23
391.2698975	0.27
399.0718994	1.55
402.4874268	0.36
404.2104492	4.18
416.1652832	4.20
417.2089844	0.32
418.2532349	10.10
427.1522827	0.25
428.3700562	0.09
432.1011963	0.25
434.1814575	1.19
435.2412720	76.92
435.8648682	0.34
439.2160034	0.43
442.1380005	0.33
443.0757446	1.24
447.1792603	1.07
451.3684082	0.46
452.1583252	0.10
455.3209839	0.10
457.9370728	0.14
462.5665283	0.48
468.7305298	0.19
471.6895752	0.37
473.5394287	0.41
475.3823853	0.81
479.0516968	0.06
486.8953857	0.96
487.6313477	0.29
489.0905151	2.74
490.3956299	0.46
491.2723389	0.14
494.4508057	0.41
499.2174683	0.16
500.3634644	0.20
511.1333618	0.70
512.4649048	0.77
513.3092651	0.13
515.1486206	3.87
516.2208862	0.44
523.5889282	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	292.08
Annotation	Hawkinsin
Peak:m/z	Relative Intensity
86.1601868	0.04
87.9245758	0.63
98.9883881	0.06
109.0423203	0.02
115.8416595	2.42
116.8981323	0.04
121.8196411	0.19
123.0371933	0.16
125.9807816	0.07
127.2449265	0.06
132.9529419	0.34
135.9427795	0.14
138.0195465	0.36
144.8818665	45.73
146.0006104	1.77
151.0305481	0.19
155.9744263	0.24
156.7770844	0.03
159.0690765	0.03
161.9429169	100.00
163.0308685	4.64
167.8256226	0.19
169.9353638	1.32
171.0690002	3.13
173.1696930	0.04
176.9622803	0.05
178.3182678	0.07
179.3891907	0.09
182.1118774	0.36
185.1676025	0.08
189.1692047	0.07
192.1248779	0.26
193.1666870	0.16
194.2947540	0.15
199.0973511	0.17
200.1207886	0.49
201.2159729	0.08
201.8342285	0.28
203.7027588	0.17
206.2733765	0.17
208.9621887	0.05
218.0586853	6.79
219.3004761	0.36
226.9500732	0.16
228.0017395	0.79
229.4930420	0.80
231.3447876	0.13
231.9841003	0.38
234.1194153	0.10
234.9824829	0.13
237.2496948	0.04
239.1687317	0.32
241.3752136	0.16
243.7867737	0.16
245.9951782	13.34
246.6478271	0.52
248.0465698	0.31
250.0797424	12.88
250.8721924	0.05
255.7680054	2.02
256.9211731	0.46
258.3478699	0.07
263.0036926	0.07
264.1612244	0.21
274.0394897	34.64
275.0477600	1.40
283.4080200	0.31
293.9931641	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	809.23
Annotation	Unknow
Peak:m/z	Relative Intensity
250.1913452	0.23
268.0654602	0.41
286.1434631	0.31
287.2222595	0.28
304.0716858	0.20
359.1361084	0.43
403.1024170	0.18
419.1065674	0.22
421.0101929	0.13
425.2749634	0.26
431.3594360	0.63
435.2361450	0.25
444.0663452	0.27
447.0093994	0.90
450.8497925	1.18
452.0958252	0.41
462.1535645	0.17
465.3920288	1.00
472.2239990	0.11
474.7895508	0.67
477.8637695	0.46
479.5444336	1.53
480.4409790	0.40
483.8958740	0.27
505.2052612	0.52
511.9669800	0.78
524.1217041	1.74
530.7017822	0.58
539.7951660	1.07
547.1427002	0.44
548.3984985	0.39
565.3295898	0.36
566.4405518	0.85
568.1006470	0.30
572.0396729	0.31
575.0564575	0.26
576.3660278	0.46
581.2647705	2.00
584.3329468	0.17
586.3903198	1.28
587.7477417	1.59
591.1015015	0.23
598.6427002	0.36
599.3549805	0.54
604.1101074	2.06
606.6648560	1.17
616.4265137	0.17
618.5902710	6.46
619.3822632	0.49
627.1170654	1.33
629.4270630	0.67
634.4381714	3.10
635.3065796	1.33
635.9589233	0.34
636.8779907	0.35
638.2972412	2.41
639.0901489	3.71
639.7642822	0.32
643.8107300	0.08
645.6600342	0.22
647.4427490	0.24
650.4839478	1.73
656.7916870	1.71
662.4904785	0.73
663.5950928	0.08
666.1066895	1.16
670.2929077	1.91
671.1991577	1.53
673.8931274	1.24
675.9874878	1.65
678.0676880	1.27
688.0195923	2.59
688.7706299	0.11
689.5629272	0.33
691.6240845	55.03
692.4926147	17.15
693.4878540	2.22
694.0931396	1.65
695.0610962	0.39
696.0105591	0.25
696.7209473	0.36
699.0382080	0.79
700.2230225	1.27
702.2176514	1.94
711.6885376	1.00
712.9700317	1.53
717.8544922	1.96
718.7825928	1.54
719.8053589	0.45
721.1660767	1.62
722.6596680	0.27
723.4904175	0.78
726.3524780	2.45
727.8231812	2.65
728.8923950	2.89
731.0083008	0.13
732.3578491	2.07
733.9158936	0.65
734.6799927	1.71
735.7239380	4.34
736.4434814	4.86
737.5861206	4.81
740.9317017	1.13
741.7117310	1.44
744.3380127	7.98
745.6111450	11.26
746.7270508	5.63
748.0417480	9.19
749.0590210	0.91
749.7887573	0.20
750.7393799	1.74
752.0774536	4.42
753.1919556	1.16
754.0472412	15.94
754.8840942	4.79
756.2308350	3.49
757.5077515	2.83
759.1295776	6.13
762.2474976	7.91
763.2807007	6.17
764.1693726	7.23
765.4249878	3.47
767.6422729	8.93
768.3496704	6.73
769.9215088	0.46
771.4165649	12.28
772.3181152	100.00
773.0401001	39.74
773.9139404	3.98
774.9395142	0.66
775.8306274	2.71
777.1199341	9.93
777.8684692	6.59
778.5915527	0.24
779.1973877	0.39
780.0900269	59.22
780.9168701	40.76
782.1564331	35.19
782.8438110	19.79
783.6861572	1.20
784.5640869	2.97
785.9912109	2.49
786.8374634	1.22
788.1477661	5.71
788.8795776	6.28
790.7050781	17.07
791.3839722	11.18
792.2774658	0.16
793.2588501	1.53
795.5131226	0.61
796.5765991	3.50
799.5922241	3.58
801.5309448	0.27
814.1079712	0.59
816.0618896	1.19
817.6743164	0.20
819.1510010	0.91
826.4412231	0.44
827.3643188	0.39
830.9998779	0.21
832.1199951	0.46
835.4287720	0.90
836.4911499	0.17
837.2074585	1.15
842.9932251	0.92
844.9744263	0.27
845.5767822	0.50
850.2112427	2.94
852.3610229	7.29
853.2817383	5.17
853.9654541	2.02
856.0409546	0.70
857.8156128	0.58
860.7034302	0.99
861.4500122	6.30
862.1896362	0.26
863.9786377	0.71
866.6235962	0.61
868.1093140	2.51
869.0347290	3.75
870.1350098	1.45
871.3645630	1.35
872.3001099	0.43
873.4484253	2.86
874.7520142	2.41
878.1083984	0.59
879.4780884	6.61
880.5697632	2.97
881.5432739	2.22
885.5751343	0.33
887.2448120	0.61
889.1327515	2.40
889.9106445	0.91
890.5292358	1.20
895.4226074	0.29
898.2083130	0.85
900.5946655	0.84
901.7005005	0.92
902.5641479	1.60
903.3762207	7.58
904.2978516	2.60
905.2833862	1.51
906.0029297	1.50
906.7710571	0.36
907.5957642	2.31
908.2321167	3.01
909.6029663	4.63
913.6643677	0.35
915.2258911	0.25
916.3385620	3.95
917.2235718	1.36
918.3073120	3.28
923.9450684	2.34
925.6635132	67.10
926.5109863	36.46
927.5023804	9.45
928.6703491	1.87
930.7129517	0.49
932.2866821	1.11
933.4368286	0.22
937.4014282	1.78
938.2409058	0.90
939.0772095	2.63
940.2183228	1.56
941.3070679	1.19
942.4989624	0.52
944.4624023	1.49
946.1314087	0.84
948.2880249	1.68
950.6878052	2.28
952.4647827	0.87
953.3121948	4.03
954.6176147	0.79
956.6336060	0.18
958.0867310	0.46
958.9043579	1.54
960.2161255	1.43
961.5090332	0.47
963.9541016	2.20
964.6895142	2.46
968.1784058	1.15
969.6528931	0.71
972.0772095	1.14
973.4537964	2.25
975.0634155	0.21
976.9465942	5.22
977.9873047	4.57
978.7373657	0.41
982.3275757	2.31
984.8772583	0.67
986.4207153	0.82
988.5520020	0.82
989.6528320	1.22
996.9680176	0.09
1004.0424190	2.30
1005.1177370	1.40
1006.2903440	1.31
1007.0206910	2.13
1007.6442870	0.12
1011.3743290	1.44
1012.0503540	0.93
1013.3117070	1.10
1014.0866090	1.67
1015.6846310	1.39
1017.6088870	0.86
1019.6062620	0.89
1020.8161010	2.38
1021.5460820	1.83
1022.6660160	0.32
1024.0178220	0.33
1030.8820800	1.41
1033.6394040	0.36
1034.6275630	3.62
1035.8837890	7.98
1039.6440430	0.26
1045.2246090	0.50
1049.1717530	0.14
1051.5091550	0.38
1055.1413570	0.13
1057.4182130	0.43
1058.2130130	1.20
1059.3244630	0.28
1060.4456790	1.32
1062.5673830	0.46
1065.7576900	1.58
1067.8234860	1.61
1070.0871580	0.44
1073.8226320	0.37
1076.2481690	0.11
1077.0689700	6.92
1078.1975100	15.88
1079.3010250	9.49
1080.3699950	2.87
1082.1506350	0.37
1088.6691890	1.37
1089.7176510	1.89
1093.4399410	1.68
1094.9199220	0.71
1095.6968990	0.21
1098.7218020	0.88
1101.0920410	0.29
1109.5009770	0.82
1112.2102050	2.16
1113.4271240	1.11
1124.1080320	0.18
1130.2509770	1.01
1131.0817870	0.51
1137.4000240	0.66
1140.4729000	0.29
1148.6193850	0.36
1159.0433350	0.30
1182.3959960	0.21
1191.2497560	0.26
1195.4989010	0.97
1197.9699710	0.68
1206.7209470	0.08
1208.0354000	0.26
1222.6252440	0.33
1240.4417720	0.25
1251.2120360	0.46
1253.6046140	0.28
1256.0028080	1.20
1257.4067380	0.43
1258.0324710	0.37
1266.1759030	0.35
1269.3873290	1.07
1286.2357180	0.31
1287.3802490	0.27
1304.6707760	0.30
1325.9774170	0.17
1329.4841310	1.00
1337.9746090	0.28
1356.5023190	0.12
1372.7119140	0.49
1373.7214360	0.41
1381.3811040	0.31
1383.6510010	0.79
1389.3690190	0.32
1413.0606690	0.27
1415.5174560	0.22
1420.3343510	0.69
1429.2734380	0.40
1440.1824950	0.18
1441.6163330	0.17
1461.1763920	0.21
1471.5115970	1.39
1497.3123780	0.23
1498.1789550	0.47
1587.7508540	0.35
1699.5596920	0.39
1722.5758060	0.49
1724.2952880	0.63
1792.2449950	0.34
1832.0281980	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	867.2345
Annotation	Lantanose A
Peak:m/z	Relative Intensity
301.3525696	0.03
363.3065796	0.42
381.2478027	0.54
525.2466431	0.84
543.1799927	10.56
543.7947388	0.09
687.2529907	2.31
705.2769165	100.00
705.9185181	0.11
807.2093506	0.02
849.5485229	0.08
866.7428589	0.02
867.6403809	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	422.1059
Annotation	Taveuniamide A
Peak:m/z	Relative Intensity
127.6476288	1.13
128.3339233	0.27
135.3023376	0.13
145.2736969	0.23
155.1083069	7.57
174.9085999	0.09
179.0922241	1.40
185.0771790	0.06
196.0139160	0.51
197.0816803	1.72
198.9810944	0.28
200.0522766	0.60
203.2271271	0.10
219.0710297	1.12
222.1820679	3.71
229.1207275	29.60
236.3276367	0.08
240.1684265	2.80
241.4869690	0.27
242.2311401	0.43
242.9735718	0.14
253.1195068	0.68
255.8810730	0.15
259.4592285	0.06
261.9817505	0.05
266.2360535	3.08
284.1741333	5.35
286.1068115	1.12
288.2832336	0.20
291.1391296	0.51
293.0866699	3.62
296.1540222	2.07
301.3544312	0.19
302.1621094	0.08
303.1235046	0.13
306.1975098	0.34
310.0345459	0.07
314.2040405	14.55
318.0516357	0.21
329.9918213	1.57
331.0649109	0.39
332.1063232	0.17
333.2226562	0.86
333.8606262	0.04
335.1348877	0.07
336.0619507	0.12
340.2182007	13.92
341.1918030	0.44
342.3680725	0.25
348.1935120	18.72
348.8919678	0.16
349.4936523	0.41
358.1240845	100.00
359.0126648	0.24
360.2885132	1.01
361.1242981	0.15
362.2085266	0.17
374.8346252	0.20
376.1983948	0.15
377.4064941	0.66
378.1492920	0.09
380.6819153	0.45
386.0164490	0.23
390.1247253	0.40
391.3563538	0.12
403.6069641	0.61
404.2404785	15.35
405.1876526	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	360.15
Annotation	Lactulose
Peak:m/z	Relative Intensity
103.1714249	0.10
126.8421021	0.08
149.0116425	0.29
162.8050385	0.18
169.1407318	0.18
172.9202271	0.38
180.1302185	0.48
183.1519012	0.81
191.9400482	0.18
197.9132996	0.22
209.8793335	0.10
211.2784424	0.20
213.1463623	0.65
221.3742676	0.27
223.0811157	6.08
224.0181274	0.45
227.1432190	0.16
228.1569214	0.77
229.3727112	0.20
231.3390503	0.72
240.3618774	0.33
241.3291321	0.04
246.4044189	0.26
253.2436218	1.45
259.0144958	4.24
261.4605103	0.09
263.0963135	0.36
270.1911621	100.00
272.1101074	0.05
277.0662231	0.17
278.0201416	2.52
279.2843018	2.49
286.2278748	0.84
288.1331177	0.29
289.1289978	0.30
291.3364258	0.07
294.1996155	24.28
294.9020996	0.18
304.6889038	0.34
306.1287842	0.29
307.1895142	1.96
311.7795410	0.84
314.1234131	1.57
316.4226074	0.68
322.1546326	0.53
324.1389160	36.09
325.0981445	3.35
329.0987854	0.46
342.1589661	18.42
343.1149902	6.39
350.9696960	0.37
353.8107605	0.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	675.2972
Annotation	Unknow
Peak:m/z	Relative Intensity
249.4873810	0.16
259.2827759	0.07
333.3536377	0.08
349.3843994	0.12
354.4653931	0.23
409.2841187	0.05
433.3999023	0.13
451.2493896	0.23
467.4710083	0.17
476.3019409	0.04
495.4967651	0.09
546.5119019	0.13
559.3863525	0.15
569.1547241	0.05
615.3328857	0.09
617.2946167	0.39
629.3443604	16.48
631.2901611	0.11
632.4432983	0.08
638.6979980	0.07
639.4108887	0.26
652.2555542	56.27
653.5681763	1.49
654.5046997	0.58
655.3178711	0.23
656.2935181	0.43
657.3638306	2.74
658.3742065	0.57
659.1739502	0.09
659.9675903	0.42
662.3626709	0.03
665.5404663	0.08
755.5146484	0.12
773.5916138	2.67
853.7688599	0.05
869.3872070	0.12
935.3258667	0.75
936.0515137	0.15
936.8059082	0.09
1096.6938480	0.03
1097.6641850	1.98
1098.7988280	0.25
1259.5250240	100.00
1260.4461670	1.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	259.13
Annotation	Leucyl-Glutamate
Peak:m/z	Relative Intensity
127.9365692	100.00
130.0816803	3.20
187.2658691	0.15
214.7828369	0.02
223.1493073	9.35
223.9042511	0.11
228.9888153	0.09
241.0910034	31.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.0712
Annotation	Deoxyinosine
Peak:m/z	Relative Intensity
104.9789886	0.55
105.9857635	0.56
145.9686279	2.83
146.7962799	0.30
148.9547729	0.26
178.1336975	0.24
179.0727997	2.42
180.0002747	0.61
181.1209259	1.22
182.2443542	1.28
184.232254	0.30
194.0436249	0.58
195.1316681	0.86
196.1355133	1.85
206.0710602	1.01
207.2561188	8.32
208.1520081	13.61
208.9942474	7.79
222.1060028	8.01
223.1093445	18.68
224.0872803	6.21
234.390274	0.42
236.3848724	0.32
251.0815887	83.83
252.0990601	100.00
253.1745453	1.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	863.2455
Annotation	Unknow
Peak:m/z	Relative Intensity
321.0487061	0.01
323.1204529	0.01
341.0161438	0.27
383.3251343	0.07
412.0708008	0.02
443.0673218	0.06
485.3219604	0.08
486.5145874	0.01
503.2924194	0.09
504.2183228	0.01
521.1860352	0.02
522.2202759	0.01
539.4932861	0.15
545.4948730	0.13
557.4953003	0.04
575.2545776	0.02
604.3682251	0.03
604.9963989	0.03
646.9051514	0.01
647.5393677	0.08
665.1237793	0.23
665.8411255	0.00
666.5974731	0.01
683.3792114	0.09
684.2496338	0.05
701.3861084	0.15
707.6570435	0.07
825.3595581	0.02
827.2992554	100.00
828.3459473	16.17
873.1187134	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	652.2322
Annotation	Unknow
Peak:m/z	Relative Intensity
184.7234039	0.02
190.1759338	0.03
191.9904633	0.09
193.0195160	0.06
197.0866852	0.04
210.1217804	1.80
211.4356537	0.13
213.1231079	0.18
228.2948608	0.08
230.9957581	0.03
236.2093811	0.10
241.7863617	0.07
242.4550171	0.12
245.2247925	0.06
254.1828003	6.19
255.1796265	1.21
260.2110901	0.05
272.1384277	7.42
273.2108459	0.79
277.1293030	0.23
288.1506348	6.57
289.2052307	1.29
306.1160583	100.00
307.2012939	11.19
322.1564941	0.09
327.2663574	0.03
329.1166382	0.03
330.1749268	0.09
340.4035645	0.16
345.2638550	0.27
356.3236084	0.05
357.2268066	0.03
358.2857666	0.01
368.2066040	0.12
373.5916138	0.02
374.2054443	0.59
375.3717651	0.07
376.4825439	0.05
378.7584839	0.03
408.2305908	0.19
424.3080444	0.05
433.0650635	0.07
435.2997437	0.11
444.4231567	0.04
451.3745117	0.15
452.3706055	0.06
455.3993530	0.09
467.5408936	0.05
473.2489014	0.01
487.4951782	0.03
490.2565308	0.05
504.3666382	0.06
518.6908569	0.05
520.2109985	0.06
522.2196655	1.60
523.2459717	1.90
524.2751465	0.48
531.2819824	0.03
547.1113281	0.04
573.4442749	0.03
580.5612183	0.13
607.6560059	0.03
609.4251709	0.04
611.6734619	0.05
617.5985718	0.06
626.2791138	0.07
633.0629272	0.03
634.2902222	4.35
635.3447266	1.99
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	380.156
Annotation	(R)-Pantothenic acid 4'-O-b-D-glucoside
Peak:m/z	Relative Intensity
112.9791489	0.30
113.9868317	0.06
115.9087677	0.53
118.9750061	0.46
120.0445099	0.06
122.9083710	0.06
124.1555939	0.07
125.0127411	0.29
126.0189514	0.11
128.1271973	0.41
129.0424042	0.19
130.8501282	0.08
141.2788239	0.04
142.0726318	0.21
142.9989166	0.52
143.8647461	0.03
146.0258942	53.89
147.0901489	4.61
159.0405273	0.12
161.0164185	1.53
162.0393982	0.10
172.8401489	0.08
174.0547638	1.12
175.2762146	0.19
177.0356750	0.12
178.9852600	0.04
183.1478577	0.03
184.3073578	0.02
188.2108154	0.23
200.1205750	2.66
201.2391052	0.42
213.1638489	0.05
216.4149170	0.15
218.1295471	5.32
219.2238159	0.78
229.3893738	0.05
242.1491394	0.33
243.2558289	0.12
244.0337830	0.03
245.2539673	0.24
251.2199402	0.16
251.8720398	0.02
254.2261658	0.09
260.3155212	0.53
261.3244324	0.07
263.0707397	3.19
264.0784607	0.39
272.1503296	0.08
274.3504944	0.02
284.2549744	0.08
290.1200562	15.55
291.1698914	2.37
292.0674438	0.02
293.1307983	0.19
294.2872620	0.06
303.3058472	0.05
307.1671753	0.15
308.1921387	67.22
309.2728271	10.92
313.2973938	0.05
314.5427856	0.19
318.2192383	0.09
319.1521606	0.18
320.3080139	0.19
321.1730042	0.06
335.1839294	0.24
339.9138489	0.14
344.3187866	0.19
361.0826721	0.22
362.2279053	100.00
363.2156677	20.86
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	631.2313
Annotation	Unknow
Peak:m/z	Relative Intensity
189.2049408	0.15
191.0752869	0.13
209.0753174	0.30
211.0625000	2.91
220.0045166	0.50
233.3966064	0.22
253.1878052	12.40
271.1473389	18.79
282.2551270	0.22
289.2113037	100.00
309.8889160	0.10
341.6403198	0.94
351.3729248	0.05
400.0341797	0.23
422.8808594	0.23
449.3652954	0.37
450.7954102	0.14
466.1539307	0.16
485.0612183	0.79
500.4616089	0.09
503.7030029	0.60
540.8051147	0.07
544.3690796	0.15
545.2467651	0.42
550.7803345	0.10
585.4542847	0.42
593.0432739	0.15
595.9067993	0.14
613.3551636	0.42
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	609.0905
Annotation	Lyngbyabellin C
Peak:m/z	Relative Intensity
174.9584351	0.27
183.0386658	0.08
184.1613617	0.25
221.8875427	0.09
250.9660339	0.30
253.0697021	100.00
254.6755066	0.23
267.1783752	0.95
278.9919739	0.28
280.2882690	0.23
309.1291504	0.21
311.1511841	0.35
322.1740417	0.12
337.3364868	0.20
338.4769287	0.15
341.6751099	0.17
351.1314697	0.19
353.9971924	0.39
355.2830200	0.52
357.0167847	58.37
370.8772583	0.09
379.9734497	0.14
381.1784058	0.22
439.1240845	0.37
440.6546021	0.38
462.2068481	0.08
477.6697998	0.30
478.8991089	0.10
501.1918945	0.04
508.5203857	0.04
511.0994873	0.17
518.4187622	0.08
535.2939453	0.10
539.8036499	0.29
543.7062988	0.13
549.3245239	0.12
552.6705933	0.59
562.2932739	1.88
563.1801758	3.58
565.4323120	0.24
573.5728149	0.12
579.8973999	0.10
590.8292236	0.70
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	476.1395
Annotation	Unknow
Peak:m/z	Relative Intensity
145.0993195	0.59
147.0838470	0.08
152.1835632	0.12
163.2174225	0.11
169.8325043	0.13
175.0437927	0.16
179.1234894	0.05
187.8542480	0.28
190.1197205	0.15
191.2604370	0.34
192.0091553	0.23
194.9054108	0.05
210.2510834	0.10
215.1263123	0.22
225.7209473	0.09
227.6384125	0.30
229.0802917	0.07
238.2752991	0.44
242.0985107	1.30
254.2810059	0.27
255.2604980	0.09
262.5104065	0.36
264.8925781	0.12
266.0043640	0.04
273.3753357	0.19
277.1207886	0.40
278.3842468	0.20
295.2212830	0.19
296.2813721	0.26
298.9614868	0.09
302.2583618	0.14
305.1055603	0.18
312.6785889	0.31
313.2946777	0.09
313.9306641	0.30
332.1795349	0.40
335.1534424	0.24
338.0729980	0.16
340.1866150	0.68
343.8793335	0.06
346.2473450	0.78
347.2587891	0.09
352.6057739	0.53
353.2531738	2.11
354.9548950	0.18
356.5406494	0.31
358.4131775	0.35
359.2107544	0.44
362.0017090	0.47
362.9546814	0.18
365.3580933	0.19
370.5648193	2.20
371.2209473	10.70
377.8697205	0.25
379.2068176	0.09
386.1990051	8.77
389.5481262	0.04
394.4822693	0.13
402.4396973	0.08
404.1794434	100.00
404.8532715	0.41
415.1564026	0.44
415.9096985	0.13
420.4622498	0.30
422.9927673	0.23
430.2435303	0.47
431.1185608	0.38
432.1714478	0.32
434.9683838	1.27
439.1737671	0.30
440.4197998	0.29
441.2780457	0.05
442.3441772	0.28
443.7345886	0.07
447.3363953	0.40
448.2805481	0.09
457.1050110	0.55
458.1213074	12.74
459.3837280	1.58
466.8580627	0.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	476.2752
Annotation	LysoPE(0:0/18:3(9Z,12Z,15Z))
Peak:m/z	Relative Intensity
146.9949188	0.14
163.9550781	0.12
169.2844238	0.17
179.9658966	0.23
194.2411194	0.09
194.9323120	0.22
216.0937958	0.31
221.9746552	0.27
254.2167358	0.07
261.2904053	0.10
266.8497314	0.53
269.1764832	0.32
280.1505127	0.05
296.9296265	0.24
304.4246521	0.44
307.1931152	0.09
313.9577942	0.06
316.2704773	0.06
317.4358521	0.05
322.9215698	0.11
335.2794800	100.00
339.7081604	0.26
349.4323120	0.05
353.3009338	0.14
356.8526611	1.01
357.8948975	0.07
358.9699707	1.60
360.8798828	0.07
362.6070862	0.11
369.2740784	0.10
381.7773743	0.24
386.2207947	0.10
387.0410461	0.19
405.9185791	0.48
411.4965515	0.31
412.5455322	0.24
413.3068848	0.08
420.1104431	0.06
422.9607849	0.13
424.9655151	0.66
432.6716919	0.18
433.2745056	0.05
434.8765564	0.13
440.1368103	0.36
440.8274536	0.18
441.8545837	0.25
444.8482361	0.07
448.9717712	0.13
458.1761780	4.75
459.1509705	0.47
460.3288879	0.11
464.4292908	0.14
466.8879089	0.27
474.5656128	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	369.1038
Annotation	Lactulose
Peak:m/z	Relative Intensity
110.8057098	0.04
112.9891663	0.06
115.2894058	0.01
131.2040558	0.02
133.9926758	0.06
143.1020813	0.05
147.2633209	0.04
159.0470734	0.03
161.0441895	0.89
171.0316772	0.03
172.3204803	0.06
176.0966492	0.04
179.0740967	0.40
180.1774902	0.06
181.0625000	0.05
187.2896729	0.07
188.9390259	3.80
195.0067444	0.17
205.0783844	0.06
206.0207214	0.12
207.1044159	0.09
210.3654175	0.04
213.0966949	0.02
222.8334045	0.01
233.0715942	0.33
233.8637085	0.20
246.2999573	0.01
248.1695862	0.02
251.1288757	0.03
261.2311401	0.03
262.5229797	0.05
263.2205811	0.04
265.3258362	0.03
268.1177368	0.06
271.2972717	0.02
275.0795898	0.01
279.0559082	0.01
282.1337891	0.08
285.2401123	0.02
288.1934204	0.03
289.0462341	0.02
293.3172607	0.04
295.4901733	0.04
297.2901001	0.06
305.3348389	0.16
308.4181824	0.04
309.3069153	0.04
313.1266479	0.05
323.1349182	100.00
325.0117188	0.42
330.1141357	0.29
331.1579285	0.78
332.4313354	0.07
333.4158936	0.16
341.2617493	0.16
345.8154297	0.02
350.1833801	0.12
351.3829956	0.16
352.1167908	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	405.14
Annotation	Bentiromide
Peak:m/z	Relative Intensity
115.9334412	0.48
127.0321732	0.22
130.1097565	0.10
133.0000000	1.03
143.8543549	0.13
144.8625183	0.11
148.9884644	0.35
162.0523376	0.15
172.8292999	1.22
174.0102844	0.16
175.1699524	0.07
200.2128754	0.06
200.9154358	0.54
202.0392151	0.26
213.0862885	0.24
214.1528015	0.14
215.0354004	0.10
216.9334412	0.70
219.1382751	1.48
226.0548706	0.55
227.0740814	0.23
236.2209473	4.89
244.2378540	1.71
245.1543579	0.22
253.6958923	0.04
255.1322327	0.39
258.4465332	2.13
259.1595154	20.78
273.1407776	19.52
274.5993042	0.44
276.0962524	100.00
278.0646362	0.20
279.3276978	0.18
281.1903381	0.17
281.9423828	0.29
287.2204895	0.69
288.2937317	0.82
290.9705200	0.15
292.9161072	0.18
295.1098022	0.14
299.2622681	0.18
300.3966370	0.20
305.4317627	0.24
313.0449829	0.47
314.2781982	0.36
315.0794067	1.91
316.7857056	0.18
324.3272095	0.33
327.2219849	0.27
329.1469421	0.16
329.7540894	0.15
331.1851807	0.17
333.2066345	0.24
340.0155334	0.68
341.3213501	0.89
342.2139587	0.87
342.9957275	0.11
344.3026428	0.26
348.2235107	1.51
352.8117981	0.18
354.4155579	0.05
355.8052979	0.71
358.0071716	0.54
359.7914124	1.42
360.4278564	0.09
361.1174011	0.11
368.9635315	0.66
370.1961365	0.20
373.3953552	0.12
377.1445618	0.08
387.2200012	10.80
388.2595520	6.52
391.0123596	0.07
395.6340942	0.89
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1243.5995
Annotation	(3b,5a,6b,22a,25R)-Furostane-22-methoxy-3,6,26-triol 3-[glucosyl-(1->2)-[xylosyl-(1->3)]-glucosyl-(1->4)-galactoside] 26-glucoside
Peak:m/z	Relative Intensity
413.7302551	0.06
443.5811768	0.05
478.3743286	0.03
611.5043945	0.01
612.6972656	0.21
653.6665039	0.06
680.5600586	0.01
707.4804688	0.09
719.5285645	0.01
755.4921875	0.10
756.9844971	0.09
757.6782837	0.14
761.0500488	0.05
773.5559082	2.45
774.4960938	0.98
775.1181030	0.02
829.7687988	0.01
859.1418457	0.01
901.3182373	0.07
902.8582764	0.09
917.4833984	0.11
919.5629883	20.31
920.6378174	8.04
935.5684814	3.55
936.6666260	1.61
973.6575928	0.03
974.5435791	0.02
975.3747559	0.02
1033.2203370	0.06
1045.0434570	0.07
1063.5612790	1.46
1064.5717770	0.73
1079.5245360	0.12
1081.5426030	100.00
1082.5523680	40.65
1083.1839600	0.35
1097.5273440	2.31
1098.5230710	0.68
1124.3175050	0.02
1182.3636470	0.04
1225.4167480	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	461.1662
Annotation	Phenylethyl O-alpha-L-arabinopyranosyl-(1->6)-beta-D-glucopyranoside
Peak:m/z	Relative Intensity
220.8945923	0.02
269.2965698	0.10
415.1994324	100.00
443.4793396	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	477.1037
Annotation	Pedaliin
Peak:m/z	Relative Intensity
151.0367432	2.52
151.8283997	0.08
153.0573883	0.97
154.1228027	0.12
156.9068756	0.07
160.0592651	0.06
161.1417542	0.18
162.0247650	0.02
162.9777832	0.54
165.0582581	0.20
169.0546112	0.11
173.0297241	0.06
174.9364471	0.06
176.7444763	0.03
179.0285950	1.33
180.2176514	0.06
181.0290833	0.16
185.1355438	0.03
187.2759094	0.03
188.4397430	0.15
189.0552368	0.35
190.0717468	0.18
190.9694824	0.04
192.0146790	0.24
193.0806580	0.21
194.0772095	0.04
198.1503601	0.08
200.1930237	0.05
200.8995361	0.37
202.2531433	0.02
202.9636383	0.03
203.9811096	1.16
205.1609192	0.76
207.1705017	0.15
212.3245239	0.02
216.3931580	0.17
217.1634827	0.32
218.0930939	0.07
220.8443298	0.07
226.0342560	0.11
227.9945221	0.13
229.1146088	0.12
231.2715759	0.16
233.0359497	0.29
234.0815735	0.12
239.0624237	0.06
241.1098022	0.16
241.8744812	0.07
243.1294098	1.73
244.3313293	0.12
245.2609253	0.10
246.2480927	0.10
247.0907440	0.58
249.1991577	0.14
254.1148071	0.30
256.1649170	0.17
257.1335754	1.26
259.1530457	0.18
260.1741028	0.05
261.0799561	0.50
266.0866089	0.09
267.2581482	0.02
267.9972839	0.17
269.3296814	0.28
270.1460571	0.47
271.1289978	5.56
272.1754150	0.18
273.0455627	1.35
273.9211426	0.05
275.2967224	0.19
277.2020569	0.03
277.8301697	0.03
280.2309570	0.04
281.3070679	0.63
282.0853271	0.04
283.2523499	0.16
285.0641785	7.21
286.1103821	3.04
287.2521362	0.32
289.1065063	0.47
290.4088135	0.03
293.2632141	0.07
295.2457275	0.11
296.2795410	0.21
297.4936523	0.26
298.1464233	0.55
299.0867310	5.33
300.1404114	2.98
301.1396484	0.64
303.1949158	0.02
306.0930786	0.03
307.1062927	0.14
309.1255493	0.25
310.2208252	0.01
311.1682739	0.65
314.0543213	100.00
315.1716614	34.99
316.2145996	0.92
322.0471497	0.09
323.1605225	0.11
324.1681213	0.08
325.2472839	0.08
327.2797241	0.33
328.5728760	0.67
329.2206726	2.52
330.2456055	0.23
331.0242920	0.20
332.8214722	0.03
337.4682617	0.09
338.2559814	0.04
339.3619080	0.53
340.2247314	0.07
342.0740356	1.53
343.2181396	0.02
344.1997681	0.20
345.3608704	0.14
351.1657410	0.11
352.8880615	0.05
355.2378845	0.10
357.1405334	24.53
358.3153687	0.47
359.1160583	0.02
360.0776978	0.07
361.3528442	0.01
363.3022156	0.08
369.2921753	0.15
372.3975830	0.11
378.7630920	0.02
387.2634583	2.35
388.2720032	0.04
399.3902283	0.06
400.5384521	0.02
409.2796326	0.09
412.9542542	0.02
426.0012512	0.05
431.1775818	0.15
432.5946960	0.12
435.7119751	0.08
441.7480164	0.08
444.2135315	0.02
449.3063049	1.62
450.3735657	0.02
457.4875793	0.07
458.7323608	0.23
459.3587952	0.15
460.4888306	0.10
462.1672668	0.56
463.3981323	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1016.3325
Annotation	Unknow
Peak:m/z	Relative Intensity
585.3538818	0.01
990.0250244	0.01
1017.6458740	0.00
1944.2298580	7.18
1977.7727050	100.00
1979.1702880	0.01
1980.2825930	0.03
1981.1339110	0.01
1981.7432860	0.00
1983.3503420	0.01
1984.2199710	0.01
1985.2385250	0.02
1987.8636470	0.01
1990.8074950	0.34
1993.3054200	0.01
1998.5010990	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1097.5415
Annotation	Elephanoside F
Peak:m/z	Relative Intensity
449.9428711	0.03
560.6250610	0.12
611.4317627	0.28
653.4509277	0.02
690.7136230	0.06
707.6158447	0.08
755.5310059	0.24
772.3076782	0.05
773.5759888	19.50
779.6408081	0.03
815.5847168	0.09
897.5316162	0.08
898.6129150	0.04
917.4147949	0.59
922.9748535	0.02
934.3565674	0.58
935.5311279	100.00
936.1794434	0.19
967.5679932	0.08
1005.8363040	0.02
1053.5655520	0.03
1056.3447270	0.05
1059.7559810	0.06
1064.5970460	0.25
1079.4936520	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	439.1821
Annotation	Unknow
Peak:m/z	Relative Intensity
143.0216370	0.02
145.0696564	0.04
149.9750824	0.02
162.9964905	1.99
205.1339111	0.06
225.3770752	0.03
233.2178345	0.03
234.8223724	0.82
243.1980286	0.04
247.2430420	0.37
253.0046082	0.01
256.1530151	0.02
258.7471313	0.02
260.2379761	0.03
262.2727661	0.05
264.7938538	1.26
277.5012817	0.02
280.8072815	0.02
283.2714844	0.11
290.9696960	0.04
297.7392578	0.08
306.9490356	0.19
308.1205444	0.12
309.2035217	0.09
314.5063477	0.03
316.1103210	0.05
319.4155884	0.05
321.1756287	0.39
323.3108826	0.22
324.6967773	0.47
325.3217773	0.38
335.4080200	0.04
339.2103577	0.26
341.0699768	0.05
349.2637634	0.06
365.4873047	0.06
376.5422668	0.07
377.3834534	0.18
379.0984802	0.12
393.2919922	100.00
395.2299805	0.38
396.5190125	0.02
407.3103027	0.03
420.5912476	0.13
421.5422974	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	407.0827
Annotation	Unknow
Peak:m/z	Relative Intensity
119.8961945	0.07
127.8878098	0.17
153.1310120	0.02
173.1891785	0.05
174.7918091	0.02
185.8329620	0.03
191.9881592	0.07
196.3513184	0.04
203.0819397	0.03
222.0798798	0.23
226.1694641	0.07
228.9649963	0.12
240.1556091	1.28
241.0198059	0.27
263.2212219	0.04
266.2191467	0.09
270.7219238	0.23
277.9281616	0.02
284.9514465	0.04
288.1894836	1.12
293.0397339	0.02
294.2064209	0.02
296.1145020	0.57
301.3662109	0.03
305.3851624	0.03
311.1172180	0.03
312.4136353	0.06
314.1465149	100.00
314.9782715	0.21
316.1968994	0.20
317.3557739	0.02
326.9775391	0.02
329.4013977	0.03
333.0695801	0.35
343.1196289	0.03
345.1632080	0.45
346.3953247	0.02
358.1940308	3.29
360.2365417	0.28
361.2040405	0.28
363.1180420	0.04
363.8764954	0.05
387.9844666	0.14
389.1926575	0.34
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	407.1723
Annotation	Ethotoin
Peak:m/z	Relative Intensity
115.9589081	0.24
121.3572693	0.03
127.8703003	0.11
142.0816650	0.79
148.9238739	0.07
159.1672058	1.08
185.9390564	0.21
189.9963074	0.04
191.1585846	0.04
201.2147217	0.08
203.0836334	100.00
215.0086212	0.16
216.0560608	0.07
224.0236359	0.18
227.0699310	0.12
229.0800476	0.07
241.0737000	0.35
242.1387024	0.25
243.5035400	0.03
256.1234741	0.04
259.2501526	0.03
269.1521301	0.05
271.0132141	0.09
273.4212341	0.14
277.3756104	0.05
281.8059998	0.08
299.4567871	0.05
301.3268433	0.29
302.2692871	0.26
303.1945801	0.19
314.3168335	0.32
317.0008240	0.12
317.9592590	0.07
320.2211609	0.18
344.1962891	0.61
345.0815125	0.18
349.1934814	0.15
353.2692261	0.04
360.7015076	0.43
361.3756409	0.22
371.1680603	0.29
377.5153503	0.13
387.2630005	0.16
388.1170349	1.26
389.1139221	1.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	407.0826
Annotation	Unknow
Peak:m/z	Relative Intensity
117.8895111	0.05
122.9002991	0.01
128.1146088	0.24
164.2410278	0.02
183.9327393	0.01
192.1510925	0.13
196.2550812	0.07
214.0098877	0.06
222.1813507	0.39
225.0245361	0.11
240.0982361	3.13
242.3166504	0.03
252.9831238	0.01
267.1460571	0.02
269.9748840	0.08
271.2893677	0.03
272.1651001	0.06
278.1556396	0.04
280.7515869	0.07
284.1822205	0.04
288.2185669	0.84
289.8404236	0.08
295.2687988	0.06
296.1634521	0.67
298.1944580	0.02
314.1489563	100.00
315.0119934	0.02
316.2250977	0.19
332.4880981	0.02
333.1368408	0.77
345.2066040	0.46
358.1504822	2.71
359.7866821	0.04
361.1443787	0.02
362.9183960	0.07
366.2004700	0.06
388.1160278	0.10
389.2042236	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	280.0826
Annotation	4-Hydroxyphenylacetylglutamine
Peak:m/z	Relative Intensity
114.8837967	0.03
126.3010941	0.04
128.9291840	0.02
137.1168823	0.08
150.0902405	0.10
155.0807800	0.05
164.0917816	4.95
176.1328278	0.02
189.0149841	0.03
192.0651550	0.03
203.8390503	0.02
220.1546021	0.07
221.0691833	0.03
223.4517517	0.08
224.4645386	0.13
233.9415588	0.02
235.3572693	0.19
236.1523438	0.13
237.3625488	0.10
244.1016846	10.95
247.3525391	0.01
252.4212341	0.04
259.1786194	0.03
262.0602112	100.00
263.0691528	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	455.1914
Annotation	Unknow
Peak:m/z	Relative Intensity
128.9985809	0.05
130.1054535	0.08
131.8991089	0.03
132.8638763	0.02
141.9971313	0.03
146.0690613	0.01
148.0353241	0.03
150.0592346	0.78
151.8931732	0.04
158.9248657	0.38
159.5332794	0.03
165.0660858	0.03
166.0579376	0.28
167.3051605	0.08
168.8447418	0.03
170.0739746	0.05
173.9416962	0.01
178.1669006	0.02
180.2171631	0.04
180.9432983	0.03
182.1034546	0.05
183.1664124	0.03
185.1864624	0.05
190.1420593	0.02
199.1100616	0.06
204.1490021	0.02
206.7768555	0.02
207.8266907	0.05
214.8880310	0.02
222.9766846	0.05
225.4242706	0.04
228.2171783	0.02
235.1090851	0.06
236.1798248	0.11
243.2239075	0.02
244.2322388	0.04
245.5523987	0.16
249.3774109	0.18
253.2691956	0.03
255.0630188	0.03
259.9657898	0.03
261.3814697	0.08
262.1955566	0.10
263.2056274	0.29
266.0971985	0.35
267.1460876	0.41
269.1154175	0.04
271.2708435	0.35
273.1618042	0.37
274.1203308	0.59
275.2669067	0.15
277.0034180	0.08
278.1813354	0.06
279.2472839	0.05
280.6200562	0.20
281.2631226	5.07
282.0392761	0.04
282.8731079	0.13
284.1682434	0.02
288.1675720	1.88
289.1353455	10.23
290.1528320	0.09
291.1942139	0.07
292.2611694	0.21
293.2724609	0.19
294.2192688	0.02
301.4888306	0.04
304.1983643	0.17
306.1763306	100.00
308.0099487	2.57
309.0800171	3.22
310.1383057	0.08
311.1254883	0.02
316.3978577	0.05
318.2710571	0.09
319.1612549	0.09
323.0878296	0.01
325.1037598	7.95
326.1948853	8.03
328.4310608	0.04
333.1394653	0.10
336.2424011	8.33
337.6455078	0.05
339.0423584	0.02
339.8227539	0.04
345.9639893	0.02
347.2107239	0.26
348.1359863	0.03
350.7225037	0.06
354.3489075	0.13
357.2854309	0.05
364.1585083	2.45
365.2276917	3.36
369.2246094	0.02
371.0852051	0.02
374.0387268	0.07
375.0271912	0.06
376.5162659	0.04
378.4842834	0.06
380.9932251	0.05
389.0192566	0.08
393.3174744	0.04
394.2555237	0.03
395.2722168	0.03
397.5527039	0.06
406.3142090	0.04
409.5619812	0.02
410.3462830	0.04
411.4354858	0.22
413.2267456	0.02
418.6559143	0.08
419.4383240	0.11
420.4079285	0.40
421.1310120	0.04
424.4278259	0.01
426.1274414	0.20
435.6498108	0.01
436.5545349	0.62
437.1953735	3.30
438.2262268	1.92
446.2887878	0.11
453.4825439	0.02
466.0900269	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	320.0454
Annotation	Unknow
Peak:m/z	Relative Intensity
88.8625641	0.24
96.9165344	0.23
98.0096970	2.69
104.9740372	0.28
106.2893829	0.48
106.8989563	0.05
110.0006790	1.37
111.9801254	100.00
132.1942596	0.79
132.8708191	3.81
135.0695953	0.15
143.9979248	9.23
146.1122437	0.16
155.8589935	0.57
167.3857880	0.17
168.8845825	1.54
169.7462463	4.91
172.9118652	0.15
175.9586334	12.08
193.0865173	0.18
196.0206604	0.19
212.1779785	1.06
213.7097778	5.33
223.2066345	0.13
229.0648804	0.13
239.1026306	0.38
241.3158569	0.34
246.0220032	18.25
247.8138428	0.77
257.0583191	0.13
261.8297729	0.20
273.1520691	0.72
273.9083252	0.33
275.2224121	0.56
276.2130432	0.59
277.1355591	0.57
279.0569458	5.43
286.2015381	0.09
301.1902466	1.37
302.0375977	0.58
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	684.13
Annotation	Unknow
Peak:m/z	Relative Intensity
197.1374817	0.36
211.3759918	0.06
214.3506775	0.07
228.2173767	0.05
230.1167297	0.08
235.2011261	0.06
236.9979248	0.10
239.9182892	0.10
246.2942200	0.14
249.2581940	0.06
252.0618896	0.35
253.1337585	0.28
254.1533813	0.49
255.1523132	0.31
256.4389648	0.14
258.0096130	0.09
264.3558960	0.15
267.1079102	0.19
272.2437134	0.90
277.7155762	0.16
279.4509888	0.17
280.2864990	0.31
286.2528076	0.06
287.1063538	0.24
288.1875000	1.06
289.1369629	0.19
289.9954224	0.19
293.2228088	0.09
295.3080750	0.16
297.3236694	0.29
303.0255127	0.06
304.5278320	0.13
305.3212891	0.20
308.3489380	0.06
309.3556213	0.10
311.0307617	0.05
315.2634277	0.44
316.3911743	0.09
317.1977539	0.03
318.0688782	0.09
319.8579102	0.06
321.1365356	0.09
321.8151855	0.12
323.1460876	0.60
324.2444458	0.77
325.5198364	0.68
326.1627197	0.77
327.1312256	0.21
328.1522217	0.08
329.1523438	0.14
332.1918030	0.15
334.3936462	0.19
341.1571350	0.98
342.2644958	0.50
345.2606201	0.16
346.3593750	0.09
348.2061157	0.05
349.5631104	0.05
352.3344727	0.18
353.1244507	0.06
355.1646729	0.82
356.1387329	0.18
357.1694946	0.34
358.1591797	0.37
359.9946899	1.06
361.1625977	0.47
362.2186279	0.45
365.1378174	0.14
371.2022705	0.04
373.0921021	1.10
374.1723022	0.42
375.2378540	0.49
376.3466187	0.21
377.2271729	0.28
378.2393188	1.17
379.2708130	0.64
380.1420288	0.81
383.2449951	1.64
384.0980835	0.30
385.3731079	0.14
387.2764893	0.21
389.0059814	0.09
390.1153564	0.20
390.9627075	0.27
396.4197998	0.21
405.3379517	0.48
406.2276001	0.60
407.8027344	0.32
408.4045410	1.01
409.1800537	1.16
410.0380859	1.13
412.1942139	0.10
414.3873291	0.09
415.3176880	0.02
416.3035889	0.14
417.2941895	0.54
422.1256714	0.10
423.3427734	0.08
424.4110718	0.03
426.2666626	0.85
427.0918579	1.04
427.7151489	0.08
428.7255249	0.48
430.2448730	0.03
431.0986938	0.35
432.8656616	0.44
434.0867310	0.43
435.4388428	0.62
438.3974609	0.04
440.3975220	0.64
441.2604370	0.24
442.5070190	0.17
447.1702271	4.48
448.1423950	6.07
449.1889038	4.21
450.2478027	0.59
451.7218628	0.50
452.3231201	3.19
453.3092041	2.62
454.0151978	0.39
457.4296875	0.53
458.2266846	0.89
459.1644897	0.95
459.8894653	0.30
460.9430542	0.34
461.7099609	0.24
463.0133057	0.25
465.3253784	0.23
466.4900513	0.13
468.1497192	0.10
470.1864624	8.32
471.2962646	3.49
472.2559814	0.76
473.1011963	0.26
474.1199341	0.17
475.2681885	0.57
479.3462524	0.41
480.3239746	2.00
481.1599731	0.52
483.2478638	0.11
484.2592773	1.90
485.2794800	2.05
486.1942749	1.71
487.1941528	0.42
488.4489136	0.41
489.3058472	2.13
490.1515503	3.62
491.2316895	2.10
492.1828003	0.86
493.3456421	0.42
496.3044434	0.11
497.0433350	0.19
498.3550415	0.17
499.1062622	0.26
500.2295532	0.08
501.3356934	0.29
502.3217163	3.88
503.3189087	2.63
504.4755249	1.61
505.4942627	0.45
506.2204590	0.37
512.9825439	0.05
514.2014771	0.93
515.3165894	0.39
516.2949219	1.42
517.2627563	0.94
518.3847656	1.29
519.1854248	0.89
520.3069458	0.46
524.1973267	0.48
525.2968140	0.95
526.1612549	0.13
530.2775269	0.17
532.3216553	0.26
533.2207031	1.91
534.2025757	2.74
535.2520142	3.25
536.3630371	8.31
537.2607422	6.60
538.3282471	4.75
540.6661987	1.42
541.4716187	0.72
542.3717651	0.62
547.1435547	0.05
549.3668213	0.05
550.1129761	0.53
551.1146240	0.60
552.1494751	0.87
553.1281128	1.21
554.1514282	4.45
555.2321167	2.89
558.1561890	13.11
559.2332153	29.63
560.2976074	15.91
561.4072266	0.19
568.2545776	27.38
569.2274780	38.26
570.2477417	39.90
571.2275391	0.08
574.1484985	0.62
576.2583008	54.79
577.2172241	100.00
578.2746582	58.97
579.3079224	0.08
580.2078247	0.19
590.4159546	1.61
591.2299194	3.79
592.1032104	3.85
593.0930786	0.48
594.2744751	0.17
599.1911011	0.17
606.2089233	0.03
608.1769409	11.77
609.2111206	33.11
610.2019043	25.83
611.1793213	4.62
612.2474976	4.99
622.2619019	0.05
623.2239380	0.13
624.1862793	2.07
625.1853638	2.62
638.1408081	0.06
639.4791260	0.11
641.2019043	1.63
642.0933228	13.77
643.1390991	13.70
647.1449585	0.47
648.2305298	0.28
665.1454468	25.80
666.1960449	20.92
667.6322632	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	842.2605
Annotation	Unknow
Peak:m/z	Relative Intensity
323.2828674	0.03
340.8541565	0.12
341.4687805	0.03
383.5140381	0.03
395.3589478	0.03
443.7244873	0.08
467.2304077	0.02
485.3339844	0.24
503.1363525	0.07
665.2793579	100.00
666.3405151	1.10
667.3540649	0.06
712.4479370	0.08
784.0831909	0.71
801.0344849	2.06
801.6714478	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	559.3123
Annotation	Daechuine S7
Peak:m/z	Relative Intensity
202.1311493	0.21
229.7165680	0.14
235.1104889	1.17
236.1836700	0.29
253.1372681	10.52
254.2558594	0.93
260.8887024	0.39
277.2723999	77.03
278.2868652	18.81
289.9835815	0.35
305.2488403	0.12
341.1408081	0.61
356.2714844	0.26
399.5126953	0.08
405.9166260	0.04
410.3632812	0.18
446.4626465	0.17
460.1813965	0.17
464.3091431	0.13
467.1575928	0.12
476.3492432	2.29
496.4002075	0.14
497.3507690	0.07
498.0045776	0.06
501.2028198	0.06
513.1343994	100.00
514.2520142	33.22
515.2905273	0.32
516.5244751	0.46
524.1762695	0.22
525.0867310	0.54
527.3178101	0.35
541.3532715	0.35
542.2347412	1.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	453.2122
Annotation	8-Isobutanoylneosolaniol
Peak:m/z	Relative Intensity
132.0701447	0.06
135.9709015	0.03
149.9262695	0.57
151.9919739	0.20
159.0002594	0.28
164.2014008	0.03
167.0063171	0.03
168.0438538	0.01
168.9178467	0.02
170.0143738	0.06
184.9579468	0.03
187.0086060	0.01
195.1219788	0.03
213.0274048	0.04
216.0727386	0.03
217.1356506	0.02
221.2218781	0.01
225.4199066	0.01
241.4761658	0.02
249.2367859	0.07
251.2323608	0.04
258.2041016	0.15
258.9716492	0.10
263.2763062	0.09
264.0324097	0.01
267.1919861	0.07
269.0454712	0.01
272.2844849	0.02
275.1885071	0.26
281.1589050	5.24
287.2588196	10.28
288.8093872	0.01
291.5068054	0.13
292.2631226	0.30
293.3175659	0.02
294.1735840	0.06
300.0241089	0.02
301.0956421	0.01
302.2460938	0.40
304.1527405	100.00
307.5222778	0.08
308.2162476	0.08
309.3249207	0.01
310.3255615	0.07
314.1448364	0.04
314.9039307	0.04
318.1810303	0.53
319.1362610	0.11
320.0501099	0.03
323.8616333	0.07
324.4822388	0.03
330.9133911	0.01
336.1826172	8.89
336.8172913	0.10
338.0028992	0.05
339.5204163	0.01
350.1224060	0.05
354.3449707	0.03
355.3997192	0.01
357.0144043	0.03
363.2213440	0.81
371.1958313	0.05
375.2610779	0.04
378.1246033	0.01
378.9121704	0.06
385.0522461	0.02
387.1025696	0.02
388.0917358	0.06
391.0410156	0.03
392.5280457	0.06
394.3427734	0.03
395.1318054	0.09
396.8984070	0.04
399.6497192	0.04
407.8402405	0.08
408.4631653	0.11
409.4187927	0.18
411.1279907	0.10
413.2966309	0.04
416.9858093	0.06
418.1996460	0.32
419.2656555	0.01
424.2443542	0.05
435.1106567	1.70
436.2787170	1.20
443.6751099	0.06
444.3338318	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1333.33
Annotation	Unknow
Peak:m/z	Relative Intensity
404.4627686	0.07
480.2904053	0.27
503.4312134	0.04
508.3293457	0.27
522.1159668	0.15
531.2532959	0.05
544.4759521	0.07
548.2284546	0.08
553.8969727	0.18
562.2583008	0.08
583.9659424	0.03
591.0139160	0.07
594.0296021	0.15
597.3547363	0.04
611.4064331	0.05
612.4266357	0.21
627.2590332	0.15
632.5043945	0.11
633.3437500	0.20
646.2432861	0.19
668.4334717	0.56
669.4055786	0.26
675.3801270	0.09
689.9276123	0.33
694.5590820	0.04
700.4533691	0.07
708.8291016	0.06
714.2348022	0.08
725.5195923	0.23
726.7222900	0.12
735.7579346	0.06
748.5379639	0.10
754.3796387	0.20
756.3607788	0.05
765.2050171	0.13
769.3715820	0.07
775.3796387	0.14
776.9580688	0.04
782.2360840	0.26
783.2899780	0.15
787.4360962	0.04
814.7268677	0.27
818.3573608	0.05
821.1949463	0.04
834.4810791	0.09
839.3105469	0.50
840.3146973	0.89
865.2091064	0.20
866.1339722	0.08
868.5484619	0.56
873.0555420	0.28
875.4199219	0.16
883.1545410	1.50
884.7703857	0.10
899.6016846	0.08
900.5073242	0.12
906.3123779	0.08
908.4113770	0.22
909.3605957	0.10
909.9786377	0.24
910.8114014	0.29
922.5032959	0.20
925.8986816	0.23
932.0313721	0.11
938.7707520	0.33
940.9686279	0.07
948.0517578	0.08
973.1102295	0.16
974.2458496	0.04
977.0010986	0.13
979.1988525	0.47
983.0366211	0.05
984.2390137	0.06
986.8023682	0.32
995.7987061	0.13
997.1683350	0.12
1000.8378910	0.03
1003.1231690	0.04
1005.1177980	0.08
1010.3052980	0.21
1014.4289550	0.72
1015.3449710	0.76
1016.6613770	0.39
1020.9296880	0.11
1026.0595700	0.06
1029.3586430	0.28
1032.7556150	0.23
1033.9860840	0.38
1035.7103270	0.24
1037.2347410	0.10
1042.3642580	0.16
1050.6193850	0.28
1064.1871340	0.12
1065.0308840	0.53
1069.2902830	0.07
1076.3479000	0.14
1077.8811040	0.45
1078.9587400	0.03
1081.9753420	0.24
1085.0834960	0.11
1092.6179200	0.12
1093.6851810	0.60
1097.1643070	0.40
1100.9672850	0.08
1107.8792720	0.69
1114.3258060	0.61
1115.0675050	0.14
1116.0600590	0.33
1123.5096440	0.41
1125.5186770	0.32
1127.7487790	0.17
1129.6970210	0.49
1132.6562500	0.62
1133.5603030	0.55
1134.1672360	0.20
1135.0781250	0.13
1140.5900880	0.69
1142.4250490	0.47
1143.4680180	0.37
1144.4047850	0.09
1145.5483400	1.42
1147.2740480	0.03
1150.2933350	0.62
1151.6474610	0.23
1153.4655760	0.42
1154.2343750	0.24
1156.7884520	0.19
1160.3887940	0.11
1163.7392580	0.14
1165.1923830	1.38
1166.3664550	1.15
1169.4680180	0.32
1170.4489750	2.42
1171.4511720	1.22
1172.2980960	0.26
1173.1549070	0.34
1173.9235840	0.12
1175.0537110	0.21
1176.2377930	0.17
1177.4279790	0.38
1178.3697510	0.55
1180.0584720	0.07
1181.2015380	0.53
1182.1726070	0.19
1183.0168460	0.39
1186.1926270	2.37
1187.0578610	5.24
1187.7636720	0.13
1188.4263920	0.05
1191.4987790	0.41
1193.0062260	0.09
1193.8890380	0.02
1194.8052980	0.72
1197.1840820	0.61
1198.1027830	1.22
1202.2023930	8.29
1203.1970210	11.06
1204.0809330	0.08
1204.7899170	0.23
1206.3740230	1.98
1207.1644290	3.49
1209.2149660	0.25
1211.3793950	0.22
1213.9514160	1.43
1215.0891110	0.58
1216.8696290	0.28
1218.2745360	4.01
1218.9571530	6.86
1219.6094970	1.93
1220.5961910	0.36
1222.1973880	5.80
1223.1281740	10.23
1224.1979980	1.58
1226.1499020	0.92
1227.1765140	1.04
1228.0856930	0.12
1230.8513180	1.15
1234.0157470	0.89
1235.0446780	0.58
1239.1525880	2.23
1240.0449220	4.25
1240.6898190	0.12
1241.8779300	0.24
1243.6738280	3.53
1244.5603030	0.95
1250.7177730	5.37
1251.5084230	1.13
1252.3323970	0.15
1253.7783200	0.43
1255.0246580	0.15
1258.0401610	1.85
1259.5826420	65.74
1260.3674320	24.77
1261.0760500	0.47
1262.6538090	0.11
1264.0843510	0.46
1266.6552730	4.39
1267.6889650	3.47
1268.7094730	0.70
1270.1879880	2.83
1271.0633540	5.44
1271.9085690	0.44
1275.3177490	56.03
1276.0339360	100.00
1277.2893070	0.43
1279.2915040	9.04
1280.0854490	16.09
1280.8400880	0.04
1282.3654790	0.12
1283.4094240	0.23
1287.5891110	0.47
1288.4443360	1.65
1290.2854000	0.17
1291.3784180	2.05
1292.5377200	1.31
1293.9869380	0.33
1296.2587890	6.75
1297.0896000	8.35
1297.8751220	0.59
1300.1636960	0.32
1305.9681400	0.04
1307.3807370	0.20
1308.2812500	0.04
1309.4011230	0.88
1311.1962890	0.11
1314.5920410	1.23
1315.1979980	0.78
1315.9591060	0.18
1317.4531250	0.58
1318.3687740	0.63
1330.7742920	0.07
1345.0340580	0.14
1349.2423100	0.15
1387.4925540	0.07
1389.1872560	0.14
1389.7904050	0.10
1390.5261230	0.25
1392.4359130	0.03
1397.2507320	0.15
1404.7960210	0.69
1405.5515140	0.29
1406.3580320	0.13
1407.2257080	0.09
1407.8387450	0.06
1416.5540770	0.03
1422.7916260	0.07
1437.6048580	0.35
1441.6575930	0.13
1444.9136960	0.04
1481.0351560	0.04
1485.1446530	0.17
1487.1341550	0.14
1491.6490480	0.49
1492.5703120	0.29
1493.3032230	0.07
1494.4968260	0.99
1501.4450680	0.04
1503.2899170	0.16
1504.4140620	0.18
1521.3032230	0.03
1523.3349610	0.16
1524.2507320	0.06
1531.7757570	0.28
1532.3813480	0.40
1539.2548830	1.64
1540.7342530	0.13
1546.0330810	0.06
1548.3482670	0.09
1549.1636960	0.30
1549.9034420	0.15
1551.1478270	0.05
1579.8778080	0.77
1583.4708250	0.13
1586.6497800	0.15
1597.1832280	0.28
1599.5528560	0.33
1601.7232670	0.09
1603.3577880	0.16
1604.9924320	0.10
1613.3935550	0.08
1616.4143070	0.11
1617.4147950	0.08
1629.7484130	0.16
1649.3292240	0.07
1651.6297610	0.11
1662.6053470	0.03
1668.7734380	0.12
1679.4758300	0.17
1690.9260250	0.16
1706.4720460	0.17
1711.6105960	0.13
1718.4385990	0.05
1723.5494380	0.04
1724.7117920	0.30
1751.7111820	0.13
1764.8469240	0.41
1767.6188960	0.11
1776.4710690	0.10
1779.3941650	0.06
1780.3133540	0.24
1781.3293460	0.08
1782.0924070	0.33
1782.7362060	0.05
1783.5257570	0.18
1795.2014160	0.18
1807.2081300	0.12
1809.6898190	0.46
1812.7126460	0.11
1824.6138920	0.22
1825.9522710	1.03
1826.6950680	0.38
1827.8233640	0.10
1841.5456540	0.23
1849.3990480	0.06
1852.5999760	0.37
1867.7235110	0.19
1868.3675540	0.14
1881.6639400	0.22
1883.4675290	0.25
1884.2181400	0.21
1898.4030760	0.12
1923.9569090	0.11
1924.8599850	0.12
1926.1256100	0.30
1939.3138430	0.16
1941.3970950	0.26
1946.5115970	0.12
1956.3117680	0.31
1956.9592290	0.17
1957.7427980	0.25
1958.5563960	0.12
1979.7850340	0.06
1995.6756590	0.19
1996.5618900	0.56
1997.3751220	0.84
1998.4724120	0.59
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	460.22
Annotation	Unknow
Peak:m/z	Relative Intensity
130.9770660	1.34
131.9588013	0.14
133.9259338	19.47
146.8640747	0.52
148.0130768	0.06
151.9534912	100.00
155.9367676	0.05
163.0792542	8.90
164.7181702	0.46
166.1742401	0.12
168.8066101	0.08
171.2537994	0.04
174.1176453	0.09
176.0103607	0.14
179.1100464	0.16
185.7490845	0.06
194.0515442	1.41
206.5542603	0.18
209.0891724	0.27
210.1625366	0.18
228.8341522	0.09
230.9667969	0.06
240.0702515	0.29
244.2720947	0.05
248.8750610	0.15
251.3047485	0.11
255.0902405	0.35
256.2786255	0.41
260.0432434	0.18
261.9392090	0.42
263.1700134	0.15
264.4634705	0.31
265.2370605	0.10
272.9758301	1.07
278.2216797	0.98
280.1296997	3.32
283.1462097	0.04
296.1134033	1.61
298.1394653	84.68
301.2067261	0.21
308.0516968	0.10
308.9616394	0.78
311.6415100	0.22
314.1154785	32.79
316.1201172	0.11
330.2457581	0.57
331.2495117	0.28
333.1595459	0.30
336.3766479	0.13
340.4454651	0.16
341.1296387	0.13
342.1662292	0.07
344.0473633	0.04
350.2985229	0.16
354.3092041	0.17
355.1506653	0.11
357.6676025	0.15
360.2203979	0.16
366.2272034	0.07
369.8714600	0.08
370.7740479	0.28
372.1655579	0.03
373.2339783	0.39
378.1374512	0.04
381.1761780	0.02
385.5132751	0.41
389.0847473	0.21
394.9845276	0.31
398.1470642	0.15
399.7424316	0.25
401.1468201	0.05
401.9319763	0.24
406.1288757	0.17
406.7522888	0.11
414.8834229	0.15
415.7454224	0.28
416.6183777	0.10
419.1977539	0.58
421.7695618	0.47
423.0698242	0.31
424.2384033	1.92
425.1836243	0.24
441.2483826	1.56
442.2766418	7.32
443.3237610	0.48
451.0385437	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	256.12
Annotation	N-D-Glucosylarylamine
Peak:m/z	Relative Intensity
84.8731995	0.02
98.7771149	0.06
113.8773804	0.13
120.8234711	0.03
124.0518494	0.03
126.9022064	0.01
130.0616455	0.02
131.7436676	0.03
139.0732880	0.02
144.1105804	0.01
148.9937592	0.06
154.9029236	0.11
155.8848572	0.02
161.9923401	0.08
167.0865021	0.10
168.8330231	0.01
181.8372650	0.03
184.1074677	0.03
190.0580292	0.02
192.2614594	0.03
194.1487885	1.23
196.0800323	0.04
200.0644379	0.01
211.1764069	0.05
212.0395203	0.26
214.2862244	0.04
215.2100525	0.04
227.4160309	0.04
238.0811768	100.00
239.2740936	0.06
247.1730957	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	522.2816
Annotation	PS(18:2(9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
155.1629028	0.06
164.1796875	0.10
165.1097717	0.05
179.2767639	0.05
184.1768188	0.11
195.2653198	0.04
195.9691620	0.03
211.2777100	0.12
219.9634094	0.02
221.3065491	0.03
226.0209656	0.03
238.1405029	0.06
242.0744324	0.23
245.2635345	0.19
255.0386353	0.30
260.1402588	0.07
263.4594727	0.20
270.5373535	0.06
276.3130188	0.02
277.4993286	0.13
288.2239380	0.04
289.0292358	0.11
296.1148682	0.09
319.4229736	0.16
321.5858765	0.24
322.3454590	0.08
323.1773071	0.04
337.2774048	100.00
337.9197388	0.11
340.3076782	0.14
342.9236450	0.04
347.0383301	0.03
349.2254028	0.23
350.4646606	0.64
357.0358887	0.18
367.1408691	0.08
369.2979126	0.02
387.1245117	0.09
389.2031250	0.13
391.7698975	0.28
395.0859985	0.09
397.5964966	0.07
399.6904907	0.09
400.5422363	0.11
406.4202881	0.17
416.2868652	0.21
417.1141357	0.62
424.4377441	0.82
432.1311646	0.33
435.4715576	0.16
459.2678223	0.05
460.6776733	0.12
464.5194702	0.10
476.8470459	0.15
485.1806030	0.04
490.8873901	0.07
497.6503296	0.07
504.2208252	11.71
504.8847046	0.44
505.5300903	0.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	275.1038
Annotation	L-gamma-Glutamyl-beta-phenyl-beta-L-alanine
Peak:m/z	Relative Intensity
94.9481277	0.39
102.9838715	0.88
109.0238647	9.04
112.0245819	0.98
126.9663849	100.00
128.0597382	0.21
130.7930603	0.04
139.3176880	0.18
147.0510254	9.74
164.0582733	1.96
174.0969696	0.11
186.4791565	0.11
203.1125488	0.54
212.4704895	0.19
213.2179260	0.64
214.1202698	1.22
217.0656433	0.16
228.7636414	0.28
231.1454468	10.10
257.1698608	24.60
275.2734070	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	326.15
Annotation	Glucopyranosylmoranoline
Peak:m/z	Relative Intensity
102.8242340	0.09
119.7339096	0.05
120.3915863	0.14
123.0521622	0.02
134.0073090	0.14
141.0791931	0.04
143.0476990	0.03
144.8757324	0.11
145.9271393	0.07
147.0371704	0.05
148.9441376	0.16
150.7997742	0.04
152.3132019	0.25
153.2017822	0.13
155.9624329	0.10
161.9448395	0.14
164.0557556	2.19
177.9850616	0.18
179.8774261	0.29
183.0876923	0.06
194.0485840	100.00
195.1296997	0.27
196.0133667	0.03
198.8188934	0.02
211.0344849	0.06
212.2041931	0.10
213.0980835	0.62
213.9767456	0.02
215.0789795	0.65
222.3616333	0.14
223.8736572	0.10
225.9845276	0.07
227.8963928	0.10
229.3082886	0.33
233.1305847	0.65
236.0138550	0.36
236.9460449	0.08
239.3106689	0.02
240.0709534	0.20
241.4754639	0.17
244.0065308	0.13
251.0640259	0.25
254.2314453	0.07
255.0246887	0.05
259.6031799	0.16
261.3109131	0.05
266.0166016	0.11
268.1871033	3.36
269.1824341	14.58
270.1083069	2.21
271.6384583	0.02
272.2805481	0.11
273.3569336	0.04
283.0227966	0.02
284.6262817	0.07
289.8395996	1.49
291.1180420	0.03
294.2788086	0.03
295.9319458	0.23
307.3303833	0.37
308.1588135	0.72
309.0703430	0.15
317.0662842	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	164.03
Annotation	Unknow
Peak:m/z	Relative Intensity
72.8747711	16.01
73.9561615	11.12
75.0089569	3.68
85.8553390	0.51
86.8808289	1.50
87.9227753	5.83
88.8814774	2.98
89.8784637	1.34
90.9191284	10.68
91.9341278	9.57
93.8619385	0.59
98.0378418	0.42
99.8287201	1.77
103.0047760	2.23
104.0487518	3.92
105.1842194	0.42
106.8741760	2.50
107.9277649	3.01
114.1501923	0.50
120.7838287	67.39
121.9021454	100.00
136.0731964	1.71
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0852
Annotation	2'-Methoxyflavone
Peak:m/z	Relative Intensity
92.03679657	0.92
95.9773407	0.32
102.9449768	0.57
104.1058044	0.41
104.9027252	1.01
108.1456299	0.29
108.9939423	0.33
123.1162109	0.58
129.0344086	2.48
130.1672058	2.05
145.9476776	1.22
147.8578796	1.12
150.9981232	48.05
151.9968262	42.43
156.0883179	1.01
165.8823547	2.50
168.0441132	3.93
169.2925568	1.48
170.0804443	1.87
172.2325287	1.33
180.2137299	2.50
181.1359406	0.78
182.2736053	0.47
184.0790405	0.67
185.0820465	0.70
186.1275024	1.46
191.1642609	0.33
191.8900299	1.30
195.2182159	0.77
198.1313019	2.59
208.9191437	2.49
211.9732361	0.29
225.2039032	1.08
226.0761871	9.97
227.4773407	0.90
236.9022369	2.31
238.2503204	7.42
239.2558594	6.59
253.0956573	100.00
254.1587677	77.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	741.4399
Annotation	Capsicoside B2
Peak:m/z	Relative Intensity
213.1927948	0.27
233.1505737	0.27
253.1731567	0.34
254.0617371	0.25
255.3320923	7.98
257.3214111	0.46
259.1704407	0.07
269.5703125	0.05
271.4152222	0.41
272.2187195	0.64
273.3202515	7.31
285.3175049	0.62
304.6995850	0.44
305.3036499	0.70
323.2346191	0.39
361.3407593	0.49
375.5878906	0.51
381.5771484	0.27
397.6853027	0.04
399.5218506	1.53
403.4899292	0.32
415.6644897	0.24
417.3144531	5.22
424.2974243	0.07
431.3887329	0.07
433.1162109	1.01
434.0103760	1.13
435.3047485	23.95
436.9935303	0.04
457.6245117	0.20
469.1741943	0.11
473.1940918	0.13
484.8200684	0.10
491.1147461	0.28
492.6852417	0.17
493.3327026	0.07
504.2465820	0.29
506.3292847	0.28
507.6441040	0.05
525.2999268	0.08
526.5728149	0.12
543.4260254	0.32
559.3788452	0.40
560.3657227	0.38
561.2739868	0.98
563.4654541	0.94
575.4341431	0.56
577.4147339	1.79
579.2458496	100.00
580.1196899	0.17
590.2500610	0.29
597.3008423	0.15
602.4174194	0.17
603.2056274	0.29
617.8375854	0.13
620.8817139	0.13
624.2334595	0.40
632.1359253	0.20
639.3657837	0.49
648.2122192	0.20
651.4376831	0.31
657.5769653	0.09
659.9971313	0.14
661.4418335	0.33
666.1012573	0.25
667.2316895	0.48
670.5606079	0.08
681.5200195	0.39
683.0801392	0.07
694.3994751	0.04
695.2908325	0.34
696.5097656	0.79
698.4499512	0.21
699.9165649	0.12
701.0695801	0.17
705.4238281	1.91
707.4884644	0.39
709.1371460	0.65
713.2896729	0.09
715.0365601	0.58
723.2036743	5.96
723.9228516	0.20
749.9531860	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	306.0766
Annotation	Glutathione
Peak:m/z	Relative Intensity
98.9148865	0.32
116.0566559	0.08
125.0586090	0.15
126.0421524	0.06
127.9678650	10.08
129.0371704	0.43
135.1473694	0.10
142.9221497	9.06
145.1766357	0.87
146.0248108	0.76
153.1772766	0.46
155.0933533	0.12
159.9671936	8.53
161.0576477	0.10
166.3439636	0.09
167.1114197	0.85
169.1680145	0.24
170.0767822	0.08
171.1247253	1.96
172.1839294	0.53
176.8729553	7.62
179.0209656	10.09
185.0747681	0.82
197.1389771	1.85
202.1506348	0.25
204.1842651	0.05
210.0022278	3.16
211.0711670	0.12
213.0419922	2.19
214.4082642	0.34
215.1024780	0.63
215.9976501	0.98
219.1006470	0.12
224.2640991	0.14
228.0075989	0.46
229.0666504	1.50
230.0697021	1.61
231.0693665	0.67
234.1699219	0.13
236.1336670	0.41
242.0980530	1.42
243.1313171	0.09
246.9537964	0.37
254.1669922	88.39
260.1797791	0.08
261.8294983	0.12
264.0494690	0.80
265.0850525	0.44
270.0092163	0.29
272.1856689	100.00
276.4130859	0.11
277.2500305	0.09
287.0900574	1.08
288.0950623	64.62
288.9583130	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	379.1609
Annotation	3-Methyl-3-butenyl apiosyl-(1->6)-glucoside
Peak:m/z	Relative Intensity
112.8564835	0.33
122.9666595	0.06
125.0483932	0.41
128.0255890	0.06
130.8595581	0.16
137.1680603	0.77
138.2589417	0.11
143.2869568	0.14
155.0592041	6.52
155.7064514	0.13
161.0376892	0.15
169.6295166	0.06
171.0747681	2.17
172.9940796	0.23
175.2199097	0.05
179.2502136	0.18
181.1491852	0.48
185.1956940	0.21
187.1975555	0.32
189.1508942	0.04
191.2243500	0.05
192.9579163	0.04
195.4176331	0.17
197.3525848	0.35
199.0634460	9.11
201.1981659	1.67
205.0584106	0.05
213.1580963	7.84
215.1606445	0.40
217.1143494	100.00
223.2109680	0.74
225.0842896	0.56
226.3317261	0.08
229.1805725	0.37
231.1213989	1.12
237.3241577	0.15
239.3251953	0.05
241.2148132	2.08
247.4424438	0.04
249.9131775	0.13
253.1241150	0.69
253.9764709	0.16
255.1617432	0.02
259.1468811	21.49
267.3993530	0.11
271.2337646	1.07
272.2196045	0.59
273.2763062	0.39
278.9189453	0.08
283.4088745	0.08
286.0385132	0.05
288.2654114	0.05
289.2861938	0.23
291.1454468	0.24
293.4692383	0.13
295.5798950	0.05
297.0989380	0.05
299.0571594	0.03
300.2564697	0.20
304.1966553	0.51
305.1941223	0.13
306.1499939	0.25
307.2863159	0.80
315.1180420	0.03
317.2474060	1.43
319.2586060	0.53
323.2427368	0.83
333.2056274	0.33
335.2397461	1.14
337.1547241	0.19
341.2822266	0.06
343.1349182	0.03
358.5664978	0.04
359.4040527	0.05
361.2268372	12.61
362.4233704	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	549.1672
Annotation	Unknow
Peak:m/z	Relative Intensity
179.1173706	0.02
189.2518005	0.06
207.0926361	5.07
341.0103760	0.04
492.4259644	0.01
503.2013550	100.00
503.8424683	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	298.11
Annotation	3'-O-Methylguanosine
Peak:m/z	Relative Intensity
107.8436203	0.02
110.9674835	0.22
112.8107910	0.18
118.8440170	0.17
123.9349670	0.04
125.9491196	0.03
130.1539307	0.02
135.9010315	0.16
140.9869385	0.04
144.1194458	0.12
145.1148376	0.05
149.1187439	0.05
152.0592957	0.53
153.0408630	0.04
161.9251404	0.13
163.0182648	0.05
164.1150055	0.18
166.0069885	100.00
167.2081299	0.04
167.9095459	0.28
175.0212097	0.19
186.7047119	0.05
191.6246338	0.10
193.1446991	0.06
195.1826782	0.13
207.0953064	0.11
208.1225891	0.01
209.0079956	0.04
210.1392212	0.13
219.1990051	0.05
220.7754822	0.05
222.2138672	0.22
227.3152771	0.04
228.0950012	0.10
239.2364807	0.18
240.0187378	0.12
245.9108887	0.11
251.7350464	0.13
253.0052490	0.15
254.2628174	0.15
255.0994873	0.04
257.1292114	0.20
263.0718994	0.35
269.9285278	0.12
278.1141357	0.02
279.1563110	0.25
280.0393982	0.78
281.1647949	0.15
283.4908142	0.11
288.6525269	0.11
289.4882202	0.33
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	318.1459
Annotation	Unknow
Peak:m/z	Relative Intensity
91.0669403	0.03
108.9892273	0.14
120.1306381	0.01
125.1744995	0.05
126.9606476	4.55
128.0734100	4.84
145.9516907	2.80
153.0730438	5.54
153.9051514	0.33
155.1723938	0.07
157.9652100	0.09
162.0229492	0.74
163.0711670	0.01
167.1864471	0.08
170.1352844	0.14
172.0634460	3.19
173.1237488	0.55
173.7623596	0.02
185.0124207	0.03
187.0346680	0.02
189.1217346	0.02
197.0043945	0.04
199.3020325	0.54
200.2755127	0.46
203.0426636	0.02
210.9931335	0.02
214.2016907	0.35
216.1773987	0.07
229.1010742	0.04
230.4525452	0.04
231.3732300	0.02
233.0672302	0.03
239.0023193	0.02
243.0897827	1.18
244.2698669	0.90
245.1281433	0.05
246.2241211	0.03
256.4082947	0.43
257.2421265	1.76
262.3004456	0.06
272.0024109	0.07
274.1592102	6.77
275.1516418	0.42
276.1661072	0.02
277.1719360	0.14
282.2363586	0.12
300.2229919	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	286.1102
Annotation	Probenecid
Peak:m/z	Relative Intensity
93.8504715	0.01
99.0667572	0.04
114.1673813	0.06
123.4033203	0.03
131.0382538	0.02
142.2519531	0.01
147.1505890	0.01
148.1323242	0.01
149.9698486	0.04
152.0660400	0.05
155.0772400	0.03
157.0431519	0.03
170.0467529	0.01
172.1495972	0.06
173.1787720	0.05
174.9858093	0.04
177.0981140	0.01
178.1129913	0.93
179.9368591	0.04
196.0016479	100.00
197.1769714	0.02
203.9308777	0.01
204.8090210	0.04
209.9267578	0.03
210.6912842	0.01
216.2572327	0.04
223.5982666	0.11
224.2961426	0.21
224.9264832	0.02
226.1143799	0.01
228.1117554	1.14
230.3262939	0.02
232.1648560	0.07
233.9320679	0.14
240.0510864	0.02
243.2284546	0.08
244.1128845	0.24
245.2443237	0.05
248.9237061	0.02
250.0953369	0.08
251.2933350	0.03
251.9929810	0.02
254.6514893	0.03
255.2798462	0.07
258.0558777	0.04
263.2448425	0.08
267.3651733	0.15
268.0112305	1.27
268.8844604	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	441.1977
Annotation	Creoside IV
Peak:m/z	Relative Intensity
162.0756683	0.02
163.0815582	0.03
210.0413971	0.02
229.2957306	0.02
235.4671326	0.06
240.4393005	0.04
246.9806213	0.08
249.2481079	0.11
265.3869019	0.02
268.6918945	0.03
296.9771118	0.02
298.9010010	0.03
305.2434998	0.07
319.1738281	0.04
321.2157898	0.08
322.1826782	0.03
331.3656616	0.10
342.2378540	0.04
343.3437500	0.03
345.3141479	0.14
346.0850525	0.09
347.6872559	0.07
348.3012390	0.04
350.4182434	0.06
352.3850098	0.02
357.2460938	0.07
362.0041809	0.04
367.1130066	0.06
382.0919800	0.03
391.9725037	0.04
392.8623352	0.07
395.2162781	100.00
396.2855530	0.05
397.4043274	0.07
399.0821533	0.04
400.1937561	0.13
403.2007446	0.07
406.6961060	0.01
411.4059753	0.05
421.2824402	0.02
423.3458252	0.22
424.4012451	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	450.1351
Annotation	Unknow
Peak:m/z	Relative Intensity
145.0980835	0.06
162.0488892	0.11
166.8339996	0.08
170.3539734	0.01
171.8969879	0.07
174.0734100	0.02
178.1238098	0.08
181.1123657	0.03
189.0771637	0.15
191.9366455	0.03
194.0945129	0.02
199.0063934	0.25
214.0365143	1.57
214.7337646	0.03
231.0246735	8.54
233.4441528	0.04
235.1020813	0.05
244.8641052	0.01
255.5011292	0.16
259.2119446	0.01
263.2373047	0.08
273.1089478	2.79
276.8666077	0.06
284.1134949	0.04
286.0590820	0.05
289.0639648	0.55
301.1629333	0.17
302.0529785	0.02
303.1984863	0.05
304.0546875	0.38
306.9182434	0.03
321.0943604	5.60
332.3182373	0.03
333.2114258	0.07
342.1751404	1.10
343.1012268	0.02
347.1074829	0.06
352.6381531	0.04
356.1339722	0.02
360.1279907	100.00
363.1410522	0.05
363.9116821	0.08
374.2203674	0.02
387.2772217	0.02
388.2873535	0.03
392.1925354	3.88
409.0619812	0.46
432.1612549	1.85
433.0953369	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.0714
Annotation	Deoxyinosine
Peak:m/z	Relative Intensity
96.88378906	2.13
99.25505066	1.13
104.8285217	1.44
145.3007965	1.53
149.1143494	5.78
152.6830597	1.82
155.4789581	4.17
173.7481232	2.05
178.9114075	7.18
181.2045441	4.48
183.6431885	3.52
188.8968353	4.68
191.1076202	3.26
192.100296	2.45
195.12677	1.00
196.2000427	3.65
206.9830017	11.72
208.2094574	11.40
209.2176208	18.11
215.1106262	2.50
221.9800262	16.39
223.1110992	4.75
233.1990967	17.98
235.0003815	3.99
251.0792084	100.00
252.2228394	39.68
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	454.1631
Annotation	Unknow
Peak:m/z	Relative Intensity
130.3134460	0.04
133.1802368	0.08
136.0264893	0.14
144.2052002	0.06
153.0975037	0.03
153.8731995	0.02
162.0211029	0.13
163.8253479	0.02
164.9900055	0.08
169.2882690	0.02
169.9907532	0.26
182.0819244	1.61
187.0353394	0.04
188.1008606	0.06
192.8772888	0.07
196.0144348	0.09
197.1733093	0.14
202.9546967	0.01
210.0966187	0.04
211.3430786	0.03
215.0078735	0.13
217.2079773	0.02
222.0852203	1.02
228.2088165	0.02
229.0689087	0.09
231.9994812	0.04
234.0920258	0.03
235.1139679	0.14
236.1206970	0.03
237.0832214	0.02
239.1329651	0.04
245.0312195	0.17
249.0738831	0.06
250.9680786	0.13
255.1192017	0.22
262.3042603	0.09
266.1029358	0.18
268.0144958	0.23
273.1331787	6.94
273.8920593	0.16
277.0895691	0.11
278.3118591	0.08
279.2177734	0.21
280.0026245	0.58
285.2026062	2.72
297.3281250	0.04
298.3063354	0.10
308.1198425	13.44
309.6753845	0.11
315.2964478	0.27
316.9605103	0.12
320.1714783	0.02
322.1879883	0.01
323.5933838	0.16
325.1125183	100.00
325.7642212	0.17
328.0443115	0.02
333.4197998	0.35
337.1078796	0.04
346.2191467	0.09
347.2495117	0.08
352.1116028	0.12
362.1583252	0.06
364.1365051	2.23
365.0669556	0.01
366.1820679	0.03
368.9808655	0.06
373.1101685	0.03
375.6134949	0.05
378.1453552	0.08
390.0909729	0.13
391.1860046	0.06
392.2779236	0.03
396.2743835	0.20
399.2878723	0.03
401.3279724	0.13
404.7860413	0.15
408.0833435	0.04
409.1535645	0.10
413.0153198	0.20
417.2162476	0.06
418.1781616	0.39
424.3404236	0.06
436.1282349	10.88
437.0266724	0.18
444.9084167	0.60
446.4329529	0.15
447.3061829	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0853
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
94.97673035	1.08
95.90920258	2.72
102.9059448	0.73
105.9120331	1.71
120.9945526	1.23
124.0203857	0.35
125.1800232	0.48
129.0885773	1.15
129.9858704	8.51
138.5370026	1.48
142.1327972	1.65
146.1452179	0.36
147.9452209	2.04
151.0085144	70.13
152.0331421	51.99
152.9521027	5.99
155.1358032	1.08
157.1866302	2.56
167.1216583	4.55
168.1450195	6.57
169.9814606	4.21
177.246048	2.17
179.0175323	0.31
180.0434723	3.48
181.9674072	3.46
184.2750854	4.11
185.8081512	2.90
195.1010284	4.33
196.7866669	1.49
197.9918213	7.03
199.171402	1.31
205.0333557	0.94
206.014267	0.60
209.1809845	7.38
210.2509766	3.71
212.991806	1.48
217.2286835	2.25
225.1022644	2.32
226.0786591	12.07
227.3457184	0.64
235.4712524	2.91
236.3175049	1.92
238.300293	7.27
239.1729736	15.46
240.08992	3.58
251.1324615	1.10
252.0192261	5.00
253.0885773	91.17
254.0800934	100.00
255.1340179	3.87
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	688.14
Annotation	Unknow
Peak:m/z	Relative Intensity
193.9381256	0.02
199.0700684	0.38
200.3251190	0.27
209.8883820	0.05
210.9082031	0.24
219.2528076	0.04
231.1962433	0.11
232.2045898	0.13
233.2332458	0.06
234.0511169	0.14
235.8650360	0.13
240.1838989	0.06
244.6849976	0.01
245.8221893	0.04
246.9045258	0.08
248.0182190	0.02
251.0962524	0.90
252.1272430	0.63
253.1019897	0.90
254.0893860	0.45
255.0533295	0.04
256.2830811	0.03
264.8878784	0.06
274.2143555	0.12
275.0234375	0.02
276.7584839	0.01
278.0700378	0.04
282.2327271	0.01
284.7472229	0.17
285.8979492	0.06
287.2119751	0.12
288.1199341	0.15
289.0226135	0.07
290.1679077	0.15
291.0498047	0.03
303.7822266	0.09
305.0717163	2.11
306.1212769	1.26
307.1459351	2.01
308.1754150	0.78
309.1021729	0.29
309.9708252	0.05
311.5194092	0.02
314.4590759	0.04
316.0783081	0.12
317.0577393	0.15
319.0703735	0.05
320.2034607	0.04
321.1278992	0.08
322.1068115	0.09
323.1773682	0.08
324.3126831	0.06
325.1212158	0.19
326.1931152	0.12
328.0598145	0.11
329.0586243	0.07
332.0541382	0.03
335.9381104	0.11
337.3752441	0.02
338.0674438	0.04
339.1395264	0.10
340.0501099	0.04
343.2054138	0.05
344.1383057	0.05
345.4316406	0.02
346.1433716	0.02
347.3552246	0.06
348.3646240	0.03
349.2232666	0.03
351.0592041	0.02
351.9567871	0.04
352.9495239	0.07
354.0213623	0.22
354.8535156	0.08
358.1944580	0.09
359.2299194	0.19
360.3363037	0.21
361.4016113	0.06
362.2047729	0.06
363.6453857	0.07
364.2851562	0.07
364.9472656	0.21
368.2065430	0.02
372.3960571	0.03
374.1422119	0.40
375.1519165	0.32
376.1040649	0.67
377.1437378	0.53
378.1409302	0.25
379.3421021	0.69
380.1613159	3.63
381.1444702	3.97
382.1434326	4.29
383.1716919	1.88
384.2327881	0.92
386.1018066	0.02
387.1639404	0.08
389.3189697	0.20
390.2231445	0.02
391.0614014	0.11
392.2404785	0.06
393.1992188	0.16
397.5828247	0.04
398.5031128	0.11
400.0323486	0.26
401.2315674	0.03
402.2276001	0.13
404.4834595	0.11
406.3632812	0.09
407.1680908	0.24
408.1582642	0.59
409.2098389	1.08
410.1926270	0.70
411.1932983	0.07
411.8513794	0.02
413.0516357	0.09
416.0664062	0.06
417.1171875	0.07
418.1970825	0.48
419.2564697	0.15
420.2869263	0.20
423.2273560	0.07
426.1751099	0.07
428.1023560	0.04
430.5053711	0.17
431.1846924	0.37
432.1737061	0.28
433.2731323	0.31
434.2073364	0.66
435.2701416	0.23
436.2163086	0.36
437.2043457	0.50
438.1267700	0.04
439.0757446	0.13
441.1865845	0.04
442.2115479	0.08
443.1461182	0.04
444.3756714	0.20
446.1065063	0.15
447.2631226	0.03
449.3234253	0.25
450.1852417	0.31
451.3031616	0.18
452.1695557	0.47
454.1747437	0.32
455.1704102	0.79
456.2099609	0.28
459.3529663	0.04
460.3393555	0.02
462.3334961	0.04
463.1638794	0.08
464.0284424	0.65
465.0378418	1.07
466.0928955	1.08
467.2443848	0.21
468.0736694	0.03
473.7869873	0.06
475.0494995	0.30
476.3010864	0.09
477.2873535	0.13
478.1539917	0.10
479.4094238	0.07
480.0824585	0.11
481.1796875	1.31
482.1031494	3.60
483.1516724	7.81
484.1025391	4.52
485.1285400	0.99
486.2610474	0.56
487.0953369	0.26
488.1799927	0.45
488.9344482	0.18
490.0560303	0.06
492.2233887	0.24
492.9580688	0.03
496.0368042	0.02
500.1455078	0.04
502.2409668	0.04
503.2772827	0.25
504.1257935	0.28
505.2583618	0.19
506.0590210	0.24
507.3035278	0.19
508.3914795	0.02
509.1143799	0.13
511.0861206	0.27
514.2333984	0.05
515.0421143	0.03
516.4791870	0.07
517.1929932	0.62
518.2160034	0.55
519.0844116	0.14
520.3120728	0.57
521.6305542	0.11
522.5065308	0.11
524.0372925	0.04
531.1455688	0.05
535.1615601	0.21
536.1458130	0.72
537.2029419	1.14
538.2800903	2.10
539.2583008	1.87
540.1612549	1.01
541.1036377	1.19
542.1472778	0.08
543.3278198	0.04
548.3224487	0.16
549.0674438	0.59
550.0476685	0.16
551.4402466	0.12
552.2712402	0.04
555.6875610	2.24
556.4733887	5.02
557.1651001	26.94
558.1195679	100.00
559.2283325	48.20
561.3327026	0.05
563.2077637	0.02
566.2604370	0.15
567.4475708	0.16
570.0791626	0.04
571.6444092	0.31
572.2788086	0.05
573.1866455	0.28
574.2731323	0.46
575.2150269	0.03
575.9185791	0.01
577.2244873	0.10
579.2466431	0.37
580.2866821	0.57
581.1946411	0.38
582.3387451	0.34
583.6701050	0.13
591.8662720	0.05
593.1812744	0.34
594.1132202	1.52
595.2587891	0.49
595.9556885	0.07
596.6168823	0.09
604.8900146	0.05
605.5252686	0.05
609.2481079	0.01
610.5516968	0.40
611.4778442	1.92
612.1170044	11.50
613.1517334	4.56
614.0435181	0.50
615.3267822	0.26
616.2195435	0.18
624.1872559	0.34
625.0784302	0.17
628.2443237	0.35
628.9277954	0.03
632.9053345	0.07
634.5202026	0.03
639.0518799	0.09
643.5905151	0.04
645.2181396	0.76
646.1968994	2.39
647.1885376	1.89
651.0564575	0.43
652.0780029	0.16
657.6698608	0.27
664.8735962	0.17
669.0885620	3.61
670.1749268	3.65
671.1334229	0.30
678.5104370	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	858.2291
Annotation	Unknow
Peak:m/z	Relative Intensity
363.2052002	0.16
381.4609680	0.15
515.7556152	0.18
525.2968140	0.78
526.0486450	0.19
543.0561523	0.05
687.4933472	0.53
705.5858765	0.29
706.4515381	0.15
777.3124390	5.03
778.0194092	0.78
779.0334473	0.16
849.2116699	1.33
850.5252075	0.08
859.5670776	0.19
867.4047852	0.10
1011.1716920	1.49
1011.7800900	0.25
1029.5015870	1.05
1030.4918210	0.16
1173.4495850	0.47
1191.3564450	1.61
1192.4910890	0.27
1335.2430420	0.15
1336.2927250	0.19
1353.5037840	1.79
1354.7210690	0.72
1497.5137940	0.42
1498.6226810	0.34
1501.8945310	0.31
1515.5560300	1.99
1516.5803220	1.74
1591.4864500	5.25
1677.5574950	100.00
1678.5549320	58.36
1679.6193850	3.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	671.06
Annotation	Unknow
Peak:m/z	Relative Intensity
200.8696289	0.03
215.8506927	0.09
217.0437622	1.27
222.8504486	0.03
225.2640686	0.03
233.1782379	0.02
236.0607605	0.10
241.0641785	1.29
241.9288025	0.05
257.0090332	2.98
258.0012817	0.90
289.9077148	0.05
293.9690552	0.04
305.8619385	1.21
312.3247070	0.06
328.9147949	0.04
347.0100098	100.00
351.2772827	0.03
379.2163696	0.05
388.0891113	0.04
517.0496216	0.14
561.1554565	0.07
583.1328735	0.05
584.6279907	0.02
588.2838745	0.04
605.6000977	0.05
609.5629883	0.03
627.7515259	0.02
629.0203247	0.04
629.8535767	0.02
633.2121582	0.03
634.6642456	0.04
636.0642090	0.05
650.1502075	0.19
652.9607544	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	579.1778
Annotation	Unknow
Peak:m/z	Relative Intensity
176.5674438	0.04
180.8144684	0.08
188.1804352	0.29
191.3783112	0.28
194.2418213	0.08
196.2006836	0.12
199.1848755	0.68
200.2027130	0.08
205.1095123	0.05
209.2185059	0.09
212.3094635	0.09
217.0682983	0.05
227.7437134	0.15
230.2172089	0.05
230.9260254	0.99
232.9948425	0.42
235.1758881	0.85
243.4090576	0.13
245.0984497	0.12
246.0979004	0.51
253.4119415	0.04
255.1138306	0.13
263.0745239	1.36
270.9967041	0.23
271.9487610	0.18
273.1343689	0.70
281.1275024	0.03
286.1378174	0.22
286.8312988	0.11
288.7982178	0.24
291.0230103	0.35
295.1947632	0.17
299.2232056	0.14
309.8999634	0.10
310.9572144	0.06
312.3445740	0.12
320.1552124	0.11
321.1154785	0.28
330.2860107	0.40
342.0542603	0.87
352.2186890	0.19
355.6794434	0.26
356.3472900	0.24
358.4135742	0.05
360.1183472	21.19
362.2858276	0.10
363.5285034	0.08
364.2272949	0.69
374.2607422	0.89
375.1542358	0.34
384.2590332	0.54
392.0977173	18.44
392.7061157	0.35
402.0587158	1.17
409.3307495	0.26
416.2583618	0.93
417.3526611	0.46
431.3590698	1.04
432.2439575	0.56
438.5347900	0.22
440.0549316	0.02
446.1860962	0.27
450.0431519	20.94
450.7000122	0.39
453.2727661	0.03
458.3485718	0.23
471.1714478	4.20
472.2354126	0.12
475.0515747	0.07
475.9400024	0.11
485.7296143	0.11
489.1491699	100.00
489.7610474	0.78
498.6917114	0.09
501.6491089	0.25
503.3088989	4.63
504.1013794	0.25
516.0517578	0.08
517.3110352	0.07
521.1901245	25.54
523.2721558	0.05
524.2922974	0.24
525.3320923	0.24
538.1853638	5.13
543.6818848	0.03
559.1080933	0.11
560.4166870	1.16
561.3347168	2.25
567.3668213	1.53
569.4728394	0.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	626.16
Annotation	Unknow
Peak:m/z	Relative Intensity
177.0754700	0.75
194.9784088	0.08
196.8235626	0.15
199.2085724	0.10
210.9166260	0.09
214.0629425	0.32
219.1082916	1.92
229.1762543	4.55
230.0737457	4.59
234.1569824	0.05
247.1837311	2.46
250.9265900	1.38
255.5773621	0.87
256.2118225	0.43
264.2299805	0.31
265.0810242	0.17
270.3506470	0.09
272.2281494	0.39
274.9058838	0.26
276.1411133	0.06
282.4939575	0.06
285.0667725	0.36
286.1938171	0.11
287.2107544	0.07
293.1195068	0.06
297.9168396	0.06
300.5522461	0.16
301.2116089	0.69
304.9525146	1.91
309.7372437	0.23
312.0427856	0.17
316.0827637	1.14
317.2822876	0.05
318.2468872	0.26
320.2111816	0.66
321.3650513	0.20
323.3060913	0.07
331.4956665	0.20
333.0924072	0.17
334.8043213	0.45
336.2231445	0.31
338.9648438	0.16
345.1340332	0.85
346.0910034	0.94
348.1491699	0.13
354.2367554	0.12
356.1379395	0.12
358.1821289	0.10
359.0216064	0.13
360.2639160	0.33
362.2388306	0.43
374.2001343	0.14
375.2650146	0.36
377.0287476	0.92
378.4226074	0.21
380.0705566	8.27
385.4096069	0.71
391.4316406	0.26
393.6855469	0.10
400.3947754	0.11
405.1555786	2.96
406.0776367	0.48
410.1187134	0.74
412.4788208	0.19
416.2830200	0.12
422.1220093	7.56
423.1868896	0.41
427.2479858	1.33
430.4110718	0.13
431.4323730	0.27
442.2832642	2.91
442.9051514	0.09
445.2467041	0.35
447.1180420	0.43
449.1481934	0.27
456.2373047	1.55
459.3812866	0.90
462.2418213	0.79
463.8448486	0.13
466.3829956	0.30
477.1243896	2.32
479.5499878	0.46
480.2231445	2.69
481.1968994	1.47
485.2672729	0.17
487.2429810	0.43
488.3152466	0.62
491.3064575	0.08
495.0690918	0.13
497.2258911	100.00
503.3167114	1.74
504.2491455	0.10
505.2872925	0.48
509.2629395	0.85
512.5193481	0.63
519.9027100	0.43
523.3776855	0.19
528.3436279	0.20
532.4595947	0.46
533.1621704	0.79
534.0271606	0.53
536.1371460	0.49
542.2623901	0.26
545.0404663	0.52
551.1051636	7.99
552.0786133	1.59
556.5834351	0.28
557.3988647	2.44
560.2495117	0.12
560.9884644	0.41
563.1287842	0.44
566.6149292	0.09
570.0025024	0.07
570.8481445	0.27
579.3855591	0.30
580.7827759	0.17
585.1666870	2.85
590.4605103	0.18
594.6071167	0.23
596.4743042	0.07
603.3672485	0.09
608.2861328	6.14
609.1911011	0.46
617.4258423	1.64
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3alpha,5beta,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
98.83378601	0.50
103.0791473	1.33
105.0326004	0.90
106.9486847	3.21
107.9150391	1.10
108.9405518	2.59
110.8467865	0.23
111.922287	0.35
112.9373474	9.74
115.0712738	1.20
116.9806213	1.21
118.7909317	0.13
121.0430603	4.02
128.9814911	3.78
130.8891449	1.94
135.0226746	3.96
135.8118591	0.35
137.0614929	1.66
139.0126953	0.38
141.0490723	0.30
142.9777679	3.00
144.839386	5.07
146.9979248	0.76
149.1258545	0.89
151.2490082	0.81
153.063858	0.76
153.9109802	0.12
155.3092651	0.29
157.1271667	1.36
159.0143127	3.63
160.8512573	2.28
163.1592712	1.38
164.9231262	0.60
168.039978	0.72
168.9799652	5.20
171.116394	0.47
173.0627289	6.28
173.9609985	0.17
174.8687439	0.63
177.0581207	1.32
179.0812073	0.20
183.1261902	2.90
184.9371185	0.67
187.1003876	2.11
188.8686981	0.23
191.2711487	0.50
192.911972	1.98
194.9037018	4.02
197.2235107	0.75
200.1071472	0.45
201.9566193	0.46
203.0913086	4.44
204.9580383	0.80
209.0440063	0.78
210.9146118	3.98
215.0120239	0.19
217.199646	1.41
218.9610596	6.03
223.1618652	0.65
226.9138489	0.31
228.1583557	0.50
229.4258118	0.23
234.9651184	6.41
239.0458984	0.51
245.3571472	2.96
247.1835022	3.78
249.5444946	0.23
250.9534912	3.97
253.154541	0.21
266.9526062	13.40
271.3903503	1.52
272.1838684	0.35
278.0006714	0.93
281.104126	0.48
283.3781738	1.11
285.2706909	0.40
287.2970581	0.85
293.5093689	0.71
295.317627	2.76
296.1496887	0.67
297.3782959	1.11
298.9501648	1.41
299.5613403	1.67
302.673584	0.52
305.4088135	8.55
307.0510254	0.57
313.4941406	3.14
323.2318115	100.00
324.1210938	0.52
325.3785095	1.26
340.463562	0.29
341.5810852	1.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3alpha,5beta,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
96.97119904	0.12
99.99710083	0.09
104.958847	0.88
106.9016266	0.34
109.0087357	0.82
110.8926239	0.79
112.1818771	0.82
112.978157	3.97
115.0626221	0.20
117.1125488	0.52
118.7891998	0.28
121.0219955	3.50
123.0561829	0.76
124.916687	0.94
126.9310608	0.83
129.034668	0.51
130.8287811	2.75
132.8961182	1.23
135.0253906	5.86
136.9323273	1.78
137.8804169	0.47
138.8504639	1.84
140.946228	0.14
142.9735107	5.97
143.8712311	0.76
144.8736572	1.73
146.059906	0.50
146.9638977	0.90
149.155304	2.10
150.9555969	2.90
151.9960632	2.45
152.9122314	1.38
153.9316406	1.46
154.9572449	1.21
157.0435181	3.57
158.1294098	0.37
158.9869385	3.50
160.3900452	0.33
161.068573	5.54
162.3141479	1.34
163.0326538	5.79
165.0712433	0.87
166.941391	0.13
169.0007477	1.43
170.8407288	1.12
173.0375061	1.30
174.8320618	3.33
176.3089294	0.19
176.9167023	1.31
178.0814972	0.19
179.0344849	0.65
182.1968994	0.11
182.9782715	1.29
183.7300415	0.29
185.09198	1.19
185.8975983	0.43
187.0758667	3.07
189.1374359	0.47
189.9317322	0.08
190.8369904	1.04
191.7875671	0.07
192.6118317	0.12
193.4525146	0.46
194.9995422	1.33
197.1317749	1.45
201.0625916	0.89
202.0451965	0.41
203.2210388	0.91
204.181366	0.10
205.1871796	1.56
208.2044678	0.09
210.6079102	0.41
211.2137756	0.70
212.3486938	0.05
213.090271	0.48
214.9860229	0.14
216.1696167	1.67
217.087616	3.39
218.1689453	3.00
219.0197449	2.84
221.1400146	0.22
223.1172791	0.73
224.8745728	0.34
227.1019592	0.33
229.1590576	0.48
231.1534729	0.38
232.9799194	0.60
233.9927368	1.54
234.8800354	1.41
235.8262939	2.23
237.092926	0.23
241.2957764	0.59
242.949707	0.18
245.1947327	6.46
247.2116699	11.06
248.9757385	0.45
250.7790527	1.60
251.9527588	0.24
254.9380493	0.33
257.2705688	0.98
259.1123047	2.04
264.4956665	0.23
265.2667847	0.36
266.9128418	2.06
267.9643555	0.20
271.0274658	0.20
273.2387695	0.47
275.9432068	0.25
277.278656	0.17
279.2428589	0.25
280.9865112	0.43
282.4220276	0.18
285.1533508	0.43
287.3959961	0.91
295.3943481	1.52
296.3647766	0.67
297.1524963	0.21
299.3144531	1.31
305.1665344	2.66
307.8668213	0.15
310.1701355	0.15
312.1340942	0.65
312.8258057	0.49
313.4347839	0.35
323.2471313	100.00
323.9724121	0.40
340.9794617	0.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	591.1779
Annotation	Atalanine
Peak:m/z	Relative Intensity
172.5629730	0.02
175.7529449	0.03
179.0778503	0.34
221.0641785	0.11
232.9977722	0.04
247.9085388	0.04
250.6556702	0.12
263.2603760	0.04
268.7751465	0.03
279.4301147	0.04
305.1266479	0.03
323.2921753	0.29
340.9631348	0.45
341.5924683	0.01
354.6677856	0.04
414.6924438	0.13
415.4536133	0.06
417.1527710	0.13
429.3571167	0.12
442.9779663	0.09
445.3458862	0.08
457.0209351	0.09
485.5648804	0.04
501.5349121	0.02
503.2811890	100.00
504.1481934	0.02
532.2088013	0.04
533.4111938	0.04
545.1972656	0.02
549.2221069	0.02
550.1785278	0.02
573.0747681	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1029.2877
Annotation	Lantanose B
Peak:m/z	Relative Intensity
292.7947998	0.08
363.1644897	1.09
379.3820190	0.04
381.2555542	0.38
450.9168091	0.08
525.2877197	9.81
543.2709351	10.13
645.1767578	0.17
687.2659912	13.91
705.2454834	47.97
705.8646240	0.11
775.5533447	0.29
777.4186401	0.18
849.3306885	25.52
849.9614258	0.30
867.2987061	100.00
867.9564209	0.85
939.2188721	0.02
969.3262939	0.39
1011.7313230	0.05
1028.9304200	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	397.09
Annotation	4'-O-Demethyldehydropodophyllotoxin
Peak:m/z	Relative Intensity
113.1927338	0.14
122.0697784	0.17
129.9975281	0.13
136.8800354	0.81
139.0049896	1.21
140.7947845	0.14
144.5976257	0.27
146.0002747	0.10
146.9405823	1.62
147.7623138	0.21
151.3496399	0.84
151.9788208	8.04
154.8560181	0.07
156.1528320	0.13
162.0044556	3.70
170.0793152	2.62
178.9898987	4.06
181.0950470	0.18
183.0360260	0.24
185.0705261	0.12
188.1062317	0.59
190.0576477	0.18
193.8944397	35.33
195.9459991	0.07
200.8915710	0.08
202.2048340	1.75
203.2936249	0.07
208.7576904	0.11
209.4023743	0.48
210.7404480	3.88
211.9987488	0.08
217.0788574	3.23
221.9051666	0.49
225.1388550	0.09
227.9196472	7.34
231.1506042	0.24
240.2326965	0.13
245.3171387	0.44
249.0835266	9.27
253.4438477	0.23
258.0419312	0.12
260.1310730	0.38
263.3117676	0.06
264.2863159	0.12
267.9645081	100.00
268.6292725	0.48
271.1680298	0.10
272.2959595	0.34
273.6917419	0.14
274.5186157	0.14
275.6456604	0.10
277.0820312	0.34
278.2478943	0.11
280.4128418	0.23
281.3120117	0.17
283.1278687	0.17
284.2469482	0.11
285.3568726	0.09
287.4357300	0.24
290.4095459	0.12
291.6331177	0.16
293.7411804	0.34
295.1489868	0.23
298.9721069	0.14
304.9097290	0.10
306.2489319	1.03
308.7509155	0.14
310.2133179	0.23
317.1018982	0.25
318.0507812	0.47
321.6288452	0.17
323.1169128	21.70
334.0369873	0.13
337.0795898	1.60
339.9236450	0.14
340.7562256	0.41
343.7919006	0.22
345.5157776	0.13
351.3659973	0.47
352.2434998	0.22
355.0976257	0.79
356.1484070	4.51
361.0361023	0.39
363.4391174	0.28
364.5006714	0.85
367.2629700	0.07
374.9136353	0.09
378.1232605	1.58
379.1418457	3.39
380.1623535	5.82
382.1529541	0.37
387.7701721	1.11
388.5317993	0.33
397.2036438	0.11
408.4064331	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	413.1661
Annotation	(2S)-2-Butanol O-[b-D-Apiofuranosyl-(1->6)-b-D-glucopyranoside]
Peak:m/z	Relative Intensity
221.0217438	0.08
250.2638245	0.01
367.1785278	100.00
369.1713562	0.13
413.2580566	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	679.7587
Annotation	Unknow
Peak:m/z	Relative Intensity
195.1684723	0.11
213.0346680	0.06
226.0864258	0.05
228.3499756	0.25
233.2067871	0.18
234.2051086	0.04
255.1560822	0.36
256.1143799	0.05
261.1751709	0.18
262.2149048	0.08
265.0722046	0.10
300.4193726	0.24
312.4694214	0.08
323.2366638	0.04
325.3716431	0.11
370.2747803	0.05
429.7070312	0.08
439.1409302	0.12
447.2902222	0.09
454.4090576	0.31
457.1538696	0.11
470.5060425	0.08
476.2369995	0.06
477.2048340	0.07
484.9581909	0.12
498.5653076	0.10
500.4385986	0.06
518.4584351	0.03
519.2645874	0.11
534.3353882	0.05
539.0635376	0.20
543.3154297	0.05
551.3166504	0.04
552.5118408	0.09
558.0250854	0.05
559.7851562	0.38
562.5877075	0.07
568.3324585	0.44
569.2976685	0.35
577.2150269	0.07
587.3407593	0.44
590.0819702	0.64
593.4741821	0.25
594.6149292	0.41
596.9954834	0.72
598.4597778	2.46
599.3259888	0.06
600.0199585	0.03
601.0997925	0.91
601.7536621	0.14
605.3196411	6.72
606.3456421	1.48
609.6115112	0.25
612.1828003	0.44
613.2059937	0.15
614.2043457	0.61
615.9098511	0.56
616.9573364	0.05
622.3980103	2.72
623.0461426	1.60
626.7454224	23.50
627.5950928	2.29
629.5621948	2.38
631.5516357	0.25
632.5476685	0.33
633.7423706	29.87
634.6151733	2.33
636.1343384	0.39
636.8568726	0.50
637.6804199	0.09
638.3043213	0.08
639.3364868	0.06
640.4497681	1.74
641.5802612	0.66
643.3449707	0.93
644.3842773	3.57
645.2193604	1.70
646.4046021	1.00
647.1748657	5.61
648.0902710	0.39
649.2258911	0.22
651.3908081	13.16
652.0634766	10.57
653.7559814	2.50
655.2539673	5.05
655.9873657	7.58
657.0471802	0.88
657.8300171	1.43
658.6867676	1.85
660.4633179	1.04
661.2697144	0.03
662.5382080	11.05
663.2761841	0.64
664.2285767	2.53
665.0093384	1.98
665.8041992	0.30
667.1575317	3.52
668.6592407	9.12
669.3134155	5.32
670.1644897	0.09
671.2080688	4.01
671.8848267	12.32
673.1458130	10.48
674.4054565	0.07
675.4299927	0.12
676.6832275	0.11
693.2579346	0.21
696.4226074	0.12
717.4128418	0.26
719.7550659	0.83
720.4190063	0.20
721.2566528	0.11
726.2868042	0.14
736.2055664	0.36
743.1110229	0.19
745.9498901	0.10
748.2891235	0.65
749.0000610	0.21
751.5518188	0.40
754.8260498	0.18
757.5525513	2.56
758.6406860	0.42
762.9619751	0.24
768.9190063	0.31
774.3745728	0.60
775.2715454	0.43
779.0491333	0.20
781.0921631	0.89
782.7626343	0.42
791.5533447	0.09
792.4279785	0.41
793.1672363	0.46
794.6630859	0.26
795.2949829	0.22
797.7626343	3.33
798.5719604	1.43
799.6983643	0.05
801.0783081	5.93
801.9750977	1.29
802.8306274	1.35
803.9450684	0.36
804.8029785	0.63
806.3022461	2.10
806.9343872	36.64
807.8881226	5.31
812.2916870	4.59
812.9404907	5.53
814.0368042	1.94
814.8968506	0.40
817.0585938	0.36
819.9673462	5.61
820.8508911	0.57
821.5101929	0.56
823.6334229	1.16
824.3212280	1.20
825.0911255	0.79
826.2411499	0.23
827.6388550	0.47
829.7167358	5.87
830.4035034	4.27
831.1961060	0.59
831.8013916	0.67
834.8065186	3.26
835.6270142	25.08
836.6036987	5.33
838.8667603	9.96
839.6265259	2.60
840.7451782	0.30
843.2171021	0.14
844.5824585	100.00
845.4885864	32.77
846.3300171	1.53
848.1387329	0.29
849.3445435	0.20
850.3062744	2.35
851.1581421	0.96
852.0245972	0.19
852.8140259	0.56
853.5137329	0.17
854.2431641	0.33
855.2413940	0.50
857.3213501	0.45
858.5320435	0.83
859.4246216	3.38
860.4575195	1.15
861.2442017	0.14
862.7822266	17.46
863.5287476	7.81
864.2343140	0.34
865.8358765	0.59
868.3712769	38.68
869.2439575	27.49
870.2583008	0.17
870.9644165	0.16
871.8671875	0.34
872.5876465	0.98
873.9071655	19.24
874.8063965	14.78
875.6776733	0.44
877.2284546	5.72
877.8908081	3.58
878.5765991	1.82
879.7006226	0.19
881.6121216	0.91
882.4182739	5.55
883.2399902	17.67
884.4695435	0.40
886.2844238	0.38
889.0772095	0.95
894.8488770	0.32
896.8399048	0.37
900.7811890	1.26
901.6044312	0.79
902.5119629	0.05
913.5294800	0.10
942.4389038	0.07
943.2905884	0.09
948.9069824	0.43
956.4456177	0.10
961.5733032	0.12
963.7499390	0.03
964.5351562	0.10
971.8584595	0.13
983.1826172	0.74
984.6296387	0.07
995.4682007	0.05
1000.6543580	0.20
1036.7426760	0.06
1048.9619140	0.07
1057.0576170	0.14
1061.4301760	0.17
1074.9628910	0.11
1078.4061280	0.09
1084.0776370	0.10
1109.5888670	0.10
1112.3500980	0.07
1125.4318850	0.35
1136.7619630	0.21
1137.4765620	0.15
1140.9731450	0.04
1152.6606450	0.13
1160.7026370	0.10
1164.9245610	0.03
1165.6745610	0.13
1176.0369870	0.15
1188.5852050	0.29
1233.4095460	0.10
1237.5352780	0.04
1277.2025150	0.17
1324.3764650	0.08
1362.4985350	0.11
1371.4024660	0.06
1380.5963130	0.08
1406.9760740	0.24
1417.8403320	0.12
1446.5072020	0.04
1510.4114990	0.07
1514.2135010	0.02
1568.8311770	0.10
1636.5236820	0.09
1678.1511230	0.07
1713.7611080	0.04
1783.9085690	0.10
1861.5101320	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	290.0704
Annotation	Hawkinsin
Peak:m/z	Relative Intensity
85.0485382	0.61
85.8653564	0.84
100.9675446	1.53
123.8587646	0.28
126.1129990	0.27
128.0699768	5.12
128.9317780	58.95
129.9880371	0.23
145.1367493	0.09
148.1697693	0.59
153.9505005	4.18
155.0783539	0.03
156.1343842	0.08
160.0267334	3.52
167.0797119	0.11
168.0636444	0.06
169.8384857	0.35
170.9837952	0.27
171.9814453	8.50
176.1885986	0.16
177.1114197	0.04
185.9853210	0.11
187.0538940	0.14
191.1624451	0.14
196.0458069	5.18
197.0238647	0.89
198.1374512	2.39
201.9633789	0.45
203.8912048	0.29
212.2727051	0.09
213.9848633	0.35
215.2529907	1.25
216.1331787	31.28
224.1927795	0.21
227.1359558	0.07
233.0451355	0.13
244.0650940	0.30
245.4171448	0.16
248.1140137	0.13
253.2474976	0.18
254.1390381	0.24
255.3548584	0.07
256.4845581	0.07
258.1628113	0.50
269.5942688	0.20
271.4204102	9.24
272.1016846	100.00
273.3253784	0.20
275.0501099	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	518.1546
Annotation	Unknow
Peak:m/z	Relative Intensity
150.2145538	0.03
161.0702209	0.09
175.9759674	68.42
177.0863342	3.80
179.0364838	1.96
180.2470398	0.07
262.8574829	0.03
268.4340210	0.05
281.0489502	0.04
281.9497681	0.13
322.1140137	0.05
337.9241333	0.10
341.1754150	100.00
342.1766968	9.46
356.2445679	0.20
357.2761841	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	391.1
Annotation	Unknow
Peak:m/z	Relative Intensity
121.1186066	0.22
124.0271835	1.88
145.2147217	0.35
148.9758759	18.34
158.1889648	0.15
161.9746552	0.14
166.2379761	1.18
166.8929749	5.10
177.8728027	0.13
211.0476837	20.70
220.1056519	0.17
222.3022614	0.12
222.9992371	0.11
229.2744751	0.16
246.1297302	0.41
255.0112305	0.36
255.6621704	0.24
260.0011597	1.39
260.7734985	2.44
262.3152466	0.21
271.3726501	0.10
274.0789795	0.27
278.8727417	7.94
279.7113037	1.46
280.3450317	0.05
290.2004395	0.17
291.2304993	0.24
293.2047729	0.51
298.1806946	19.43
299.3024902	7.36
300.8922729	100.00
301.5965576	0.47
302.6208801	0.82
303.4017029	0.57
310.1887817	0.90
313.7057800	0.43
318.5216980	0.12
328.9440002	0.18
331.2382202	0.06
332.8854370	0.52
334.4291687	0.16
338.0187378	0.14
345.2004089	0.30
348.4083862	0.19
349.2246399	0.22
350.0534973	0.06
354.3902893	0.28
355.0616150	0.07
356.2098694	0.21
358.2356262	0.53
361.1548157	0.33
362.4676819	0.41
372.1336975	0.41
373.0696716	0.69
390.5894470	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	448.1216
Annotation	Unknow
Peak:m/z	Relative Intensity
126.6922531	0.12
128.0699615	2.80
135.2216644	0.13
146.0393982	0.10
153.0798035	0.06
155.0988922	9.58
168.1004333	0.11
175.8882751	0.16
179.1539001	0.97
185.1222229	0.26
193.9663696	0.16
195.4869843	0.18
196.2781067	1.38
197.1351013	1.43
220.1286774	0.08
222.2263489	5.64
229.1279144	16.51
238.2500305	0.72
240.1975708	11.64
245.2346497	0.50
264.3306885	0.48
266.1496277	5.64
268.2235107	0.87
271.2816467	0.08
272.1389160	3.70
276.2795105	0.08
284.0413513	8.51
286.5286255	0.16
288.2652588	0.24
296.0746765	2.35
298.1468201	1.05
299.9777832	0.28
312.0722046	0.87
314.2622070	52.81
316.2389526	1.79
319.1154175	1.08
338.2650452	0.39
339.0792847	0.34
340.2043762	7.39
346.2440491	2.17
356.1666565	0.33
358.1548767	100.00
358.7595520	0.15
361.5822449	0.03
372.2518921	0.50
374.1967163	17.60
376.2406311	0.06
384.3420715	0.06
386.2998657	0.04
390.1425171	8.57
392.5328674	0.55
401.2374878	4.52
402.3862915	1.15
404.3399353	0.06
407.1319885	11.17
430.1269836	8.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	345.1125
Annotation	Ovalifolin
Peak:m/z	Relative Intensity
128.0152740	7.03
140.0692902	0.05
153.1884766	0.13
184.0556335	11.21
215.0490112	1.22
217.1748352	0.11
227.1600647	0.20
249.0985413	0.08
253.1445007	0.49
258.0502625	4.60
259.5070801	0.15
268.4273376	0.08
271.1443481	1.86
277.0994263	0.27
280.1062012	0.10
281.1343994	0.11
283.2880554	0.10
287.3107300	0.04
289.0878906	100.00
299.2430420	1.70
301.9424744	0.19
309.1609497	0.07
326.1711426	0.23
327.2401123	0.71
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	536.1179
Annotation	11-O-Demethylpradimicinone I
Peak:m/z	Relative Intensity
156.0075378	0.72
193.8854218	0.40
205.2074585	0.15
210.8920288	0.04
225.2747803	0.15
228.1184540	0.06
234.9933624	0.05
243.2799988	0.09
247.9070435	0.24
250.0302277	0.11
255.9049530	0.09
266.8008423	0.02
275.2766113	0.13
281.1501770	0.16
282.1593018	0.08
305.4579468	0.23
306.1494141	0.19
311.7554932	0.05
316.9748535	0.06
320.0058594	0.04
323.1104736	4.44
338.4044189	0.06
339.2153931	0.05
343.0557861	0.17
356.2297974	1.05
357.9769287	0.08
358.9211426	0.23
373.9754639	0.46
374.5920410	0.51
380.6544800	0.23
381.3215942	1.96
406.3298950	0.29
419.1337280	0.20
423.7704468	0.03
428.0425415	0.31
430.1506958	0.44
444.2081909	0.20
446.1348877	100.00
446.9250488	0.71
456.2825317	0.07
474.9345093	0.07
476.0343018	0.27
478.2049561	0.05
483.5848389	0.07
484.6969604	0.06
486.3023071	0.06
490.3918457	0.24
491.5305786	0.14
495.0713501	0.56
498.8818970	0.04
499.8795776	0.42
500.5136108	0.09
503.5144653	0.14
517.2510376	1.20
518.2954712	1.51
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	261.15
Annotation	Cordiaquinol J
Peak:m/z	Relative Intensity
92.80857849	0.22
95.1211853	0.07
114.9968567	0.23
122.9089813	0.14
148.1647034	0.07
150.9812927	0.21
153.0051727	0.12
155.0874481	0.18
157.2258759	0.15
173.0165863	0.04
174.9677582	0.08
176.2393036	0.06
179.0919952	0.07
189.130188	0.15
191.8637238	0.09
197.1795807	0.07
199.0501709	0.13
216.9088135	0.25
218.1569824	0.54
219.5024109	0.09
223.0880585	0.15
226.02211	0.07
229.2809601	0.70
231.2234497	0.11
233.9093628	0.08
243.1348114	100.00
243.9809723	0.24
245.1341553	3.37
261.4238281	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	426.29
Annotation	Prostaglandin E2 serinol amide
Peak:m/z	Relative Intensity
132.6050873	1.07
134.8870544	1.24
144.8207703	1.16
150.0971985	1.32
154.2901459	1.03
159.3421631	2.12
160.9414368	0.32
162.9893494	2.23
167.0472107	1.66
173.175827	1.35
175.1147156	0.86
184.9062195	1.04
195.3440247	1.28
198.1669769	2.93
214.1421661	0.96
218.2787476	3.73
223.0048218	1.92
224.9458923	0.60
228.2512207	0.46
230.1975403	0.86
235.2800293	0.86
236.0837708	0.67
238.1078796	0.65
239.5664368	1.37
247.3158875	1.79
250.1516724	0.97
255.3603516	0.58
263.3226929	3.07
267.2315369	2.53
268.2156067	1.01
271.6517334	1.55
281.2851562	1.35
282.3271179	0.35
286.7673035	2.54
287.9982605	0.70
293.0762939	1.96
294.2201538	1.31
295.0811157	0.77
296.5222778	0.68
299.1575012	0.70
299.9415894	1.28
306.1675415	23.51
310.156189	16.00
313.9751282	1.12
316.188324	0.60
319.5230713	7.04
320.3599243	2.30
321.0637512	4.38
324.2669983	14.31
326.2674561	0.72
328.058197	0.39
334.0674133	4.39
336.2732239	8.87
339.237915	3.31
341.1799622	2.91
342.0743408	0.55
343.3178101	8.95
352.2774048	82.92
356.2253113	0.77
357.1439514	1.91
358.8864746	0.32
360.2994385	0.95
361.3133545	24.82
362.20401	0.28
363.9660645	0.28
366.4108276	1.09
367.7366638	1.62
370.0190735	3.76
372.8994141	1.65
376.8008728	1.38
380.3169556	23.04
382.6914368	0.39
384.3634033	3.47
385.1930847	4.72
387.447937	0.42
389.6134338	3.24
390.8856506	4.87
392.5036316	1.64
395.6599731	0.70
398.3291931	29.97
402.7460022	0.73
408.2650452	100.00
409.830658	3.53
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	686.13
Annotation	Unknow
Peak:m/z	Relative Intensity
197.1459961	0.19
212.0607452	0.12
216.2111664	0.14
237.1271820	0.06
238.4091187	0.10
254.1715240	0.83
255.2827606	0.46
256.1427612	0.17
266.3472900	0.08
272.4800720	0.39
273.2934265	0.41
281.2869263	0.09
286.1828918	0.26
287.0771790	0.16
288.0541992	1.05
289.2219543	0.21
290.2136841	0.51
292.2683716	0.35
303.1441345	0.17
304.2059937	0.18
305.1748047	0.10
310.0652466	0.04
313.9747009	0.04
321.2508545	0.06
323.2340088	0.66
324.2142334	0.41
326.1373291	0.15
327.2475891	0.46
333.1348877	0.05
341.2150879	0.36
342.4030151	0.55
347.3100586	0.24
349.1566162	0.13
355.1685181	0.23
359.0932007	0.22
359.9791870	0.05
361.2152100	0.72
362.2150269	0.26
363.2271729	0.20
371.2887573	0.34
373.0655518	0.28
374.8299561	0.63
375.4984741	0.09
376.1085205	0.34
377.4543457	0.15
378.5902710	0.10
379.3369141	0.44
380.2426147	0.80
381.2393188	0.59
382.1690063	0.09
383.3175049	0.61
384.2399902	0.80
385.3811646	0.13
386.3942871	0.07
387.5617676	0.05
388.9140015	0.20
390.3549805	0.20
391.3959961	0.41
393.0578613	0.13
395.6699219	0.04
397.5093994	0.11
399.2814331	0.11
401.1561279	0.07
406.2359619	0.62
407.2474365	0.12
408.0590820	0.59
409.2658081	0.08
409.9749146	0.06
413.3410645	0.24
415.3643188	0.08
416.4822388	0.22
417.3509521	0.53
418.4046021	0.37
419.3070068	0.21
420.5925293	0.10
422.2014771	0.13
424.4272461	0.13
426.6071777	0.43
427.3412476	0.16
428.2456055	0.47
430.1676636	0.59
431.2901611	0.46
432.2742920	0.19
433.2641602	0.12
434.2414551	0.36
435.2443237	1.09
436.3407593	0.81
439.2285767	0.11
441.1963501	0.10
442.3698730	0.28
443.1904907	0.23
444.2265625	0.04
447.2605591	1.31
448.2196045	2.26
449.0574951	2.80
450.2886963	2.61
451.2250977	0.83
452.3110962	2.30
453.1369019	2.43
454.3621216	1.24
458.3946533	0.57
459.0652466	0.28
460.2777100	0.49
461.1452637	0.03
462.4074707	0.15
465.0816040	0.21
466.1213379	0.18
469.1227417	0.20
470.3111572	4.75
471.3348389	3.08
472.2864380	1.11
473.3750610	0.62
474.2667847	0.28
475.3153687	0.17
476.0415039	0.67
477.2671509	0.52
479.2794800	0.11
480.3272095	0.30
481.2393799	0.32
482.0737915	0.15
483.9105225	0.36
485.6013184	0.52
486.2959595	0.27
487.2962036	1.11
488.1578369	0.15
489.1527100	0.60
490.2829590	0.84
491.1738281	1.14
492.1723633	1.99
493.4940796	1.28
494.4290771	0.46
495.3011475	0.28
496.1207886	0.26
499.0620117	0.14
500.3629150	0.22
501.2066040	0.46
502.4108276	1.26
503.3591919	1.54
504.3459473	0.90
505.3212891	1.82
506.2172241	1.84
507.3963013	0.47
508.1898193	0.04
511.6954956	0.04
514.5358887	0.68
515.3574219	1.51
516.1358032	1.27
517.1293945	1.73
518.3428345	0.78
519.4783936	1.20
520.2780151	0.25
521.3544312	0.60
522.2987671	0.30
523.4087524	0.76
524.0566406	0.07
525.3124390	0.14
526.2097778	0.56
527.1674805	0.67
528.2252808	0.05
532.5438232	0.19
533.2023315	0.70
534.1599731	1.23
535.2271729	2.40
536.1945190	7.75
537.2308350	14.83
538.2061768	16.17
539.2430420	11.84
540.3378906	4.02
541.2152710	1.37
542.2138062	0.48
543.2630005	0.35
544.2456665	0.26
545.2025757	0.52
546.5238647	0.22
547.4949341	0.08
552.3330688	0.51
554.3013306	0.55
555.2352905	1.23
556.2404175	4.21
557.2214966	3.12
558.3142700	4.76
559.2195435	12.40
560.2709351	11.65
561.2213745	20.69
562.2479858	6.59
565.2014771	0.37
566.4839478	1.08
567.3460083	0.23
568.1357422	1.44
569.1543579	5.39
570.2149658	11.84
571.1631470	18.60
572.2340698	12.17
573.3508911	0.88
576.2859497	16.93
577.2825928	57.94
578.2570190	54.14
579.2205811	71.67
580.1949463	20.50
581.4410400	0.13
582.5250244	0.19
585.9790039	0.07
590.2200317	0.51
591.0730591	0.21
592.1502686	0.47
593.1702271	2.57
594.1608887	0.85
594.9877319	1.19
595.8182983	0.06
600.1809082	0.33
601.3350220	0.07
602.4800415	0.66
603.3694458	0.69
604.3453369	0.51
608.1144409	0.07
609.2882080	4.19
610.3140259	5.32
611.2513428	12.79
612.2463379	6.66
613.2498169	10.75
614.2929688	5.05
623.4995117	0.06
625.1188354	2.51
626.1439819	6.64
627.1640015	2.69
628.1541748	0.23
641.8414917	0.94
643.0712891	11.47
644.1638794	100.00
645.1906128	41.24
648.8192749	0.24
650.1292114	0.85
651.6690063	0.07
654.4675903	0.08
665.8172607	0.55
667.1173096	40.10
668.2172241	16.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	377.09
Annotation	Lactulose
Peak:m/z	Relative Intensity
119.2007141	0.05
161.0590820	0.08
178.9248505	0.62
197.0980682	0.61
215.0202637	9.41
219.1122131	0.15
341.1464233	100.00
341.7648315	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	467.2136
Annotation	Ebracteatoside C
Peak:m/z	Relative Intensity
164.8009949	0.11
167.1951599	0.02
198.9917297	0.19
203.1396484	0.07
209.9950562	0.24
222.9885559	0.47
236.1799622	0.04
245.0370178	0.05
246.9704590	0.13
253.1106873	0.30
255.4559326	0.05
265.2739868	0.04
272.6626282	0.25
273.2634277	0.65
275.3355408	0.18
281.2846375	0.09
286.2164917	0.28
287.2702026	0.21
303.3053284	0.08
304.2147827	1.27
305.1385193	1.60
322.1382446	0.06
326.2342529	0.17
330.9410706	0.05
334.7171936	0.07
337.2373047	0.21
347.1630859	0.08
357.2458496	0.04
359.3022766	0.03
367.6233215	0.06
371.0465393	0.05
375.4334412	0.31
378.4537354	0.07
379.1551208	0.16
382.6491699	0.05
387.2424622	1.54
393.1972351	0.08
395.3014832	0.06
407.3201599	0.05
409.2958069	0.15
421.2566528	100.00
423.2343140	0.54
425.2113342	0.17
426.4885254	0.07
431.2823181	0.04
434.5691223	0.04
448.4073486	0.19
449.2329407	0.22
452.0870056	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	392.1134
Annotation	(gamma-Glutamyl-gamma-glutamyl)-S-methylcysteine
Peak:m/z	Relative Intensity
124.9749222	0.08
128.0091248	2.56
132.9327850	0.05
135.0420227	1.14
143.0254211	5.26
145.9225769	1.44
160.0180817	0.37
166.2326965	0.10
166.9248352	0.44
169.8811951	0.16
171.0142212	0.31
176.3991852	0.07
177.0988770	0.51
179.0462341	8.30
185.1323242	0.22
191.1175232	0.14
192.1719208	0.23
197.1327972	0.29
210.1860046	5.93
213.2380066	0.07
228.0133972	0.31
231.3113708	0.06
236.0966187	0.61
241.9757996	0.14
245.2000732	0.11
254.0742493	67.32
258.0802612	0.50
263.0333862	6.16
272.1412659	100.00
288.0834045	4.08
300.9958496	0.20
302.1277771	0.82
306.1579895	45.84
350.0664368	0.51
351.0838623	7.71
356.2887878	0.11
374.0846863	16.86
374.7059021	0.20
375.3060913	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	434.11
Annotation	Unknow
Peak:m/z	Relative Intensity
131.8940430	0.06
172.9760437	0.22
183.9827423	0.12
246.9320068	0.35
249.2215271	0.31
256.1082764	0.11
270.2408142	0.06
271.2697754	0.32
272.1398621	0.66
282.9978638	0.20
285.0473022	0.16
285.8653870	0.11
288.1478882	0.31
294.1122742	0.14
304.4184265	0.63
305.2001953	0.16
306.0108032	0.49
309.2056274	0.19
310.1369019	0.38
311.0552673	0.20
313.4825439	0.14
315.0905762	0.19
318.0745544	0.20
328.1857910	0.14
335.3205566	0.06
336.0871277	0.09
337.9913940	0.07
344.3450012	0.28
346.3088989	0.40
347.4068604	0.16
348.8975220	0.14
351.4121094	0.09
360.0460205	0.30
362.1443481	0.48
369.4374084	0.07
371.2912292	0.10
375.8469238	0.11
378.2087097	100.00
387.0894775	0.19
388.3163147	0.78
389.3159790	0.73
390.2012024	0.89
393.0474243	0.76
397.1368713	0.37
413.6238098	0.26
414.9731750	0.43
416.3523560	0.70
417.2789307	0.06
419.2193298	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	311.123
Annotation	Tyrosyl-Glutamate
Peak:m/z	Relative Intensity
95.0487976	0.11
109.3115921	0.20
117.9043884	0.10
119.0687408	0.88
123.1383057	0.40
129.9247131	0.16
131.7433167	0.06
133.1811523	0.28
134.1699219	0.04
136.0339661	6.66
146.8413849	0.96
148.0769348	0.31
148.9771576	0.39
151.9180756	0.06
164.9917297	19.67
165.9850006	0.07
166.9760742	0.13
169.0092010	0.07
177.1332550	0.07
179.9594727	0.03
181.9814758	100.00
184.0952454	0.26
191.0792999	0.12
192.8142090	0.07
194.1431274	0.09
204.4328613	0.15
210.6566467	0.24
216.6396179	0.15
217.7734070	0.34
219.0734558	1.06
221.1041260	0.19
224.4034424	0.08
225.6306763	0.13
232.9517822	0.08
236.2962646	0.03
237.1249084	0.05
241.4792480	0.11
244.9686890	0.07
246.0324097	0.18
247.2538757	0.06
248.0469666	1.03
251.0444946	0.06
254.2536621	0.14
255.4154053	0.06
256.9095459	0.09
264.0885620	0.10
265.0431824	1.26
265.8971252	0.25
267.2432861	0.08
269.3363647	0.39
270.0961304	0.24
275.1802368	0.06
279.6817017	0.39
281.3474731	0.06
282.3566589	0.50
283.1620483	0.35
290.0545959	0.13
291.1530151	0.22
292.1134033	0.30
293.2986450	4.09
294.2437744	7.21
299.2656860	0.06
301.9085693	0.42
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	327.6265
Annotation	Unknow
Peak:m/z	Relative Intensity
109.1231003	0.05
109.9087524	0.04
117.1278229	0.03
124.0631714	0.03
127.8641663	0.47
128.8377380	0.03
130.2862854	0.07
132.8220520	0.55
136.0240173	0.12
145.0575104	0.09
148.0752869	0.25
150.1232605	0.07
152.0830688	0.10
153.0473175	0.15
158.3537598	0.12
159.0366821	0.04
160.1847839	0.13
161.6721954	0.30
162.3009338	0.31
165.1981201	0.11
168.0198364	0.03
170.0051117	0.11
171.1096497	0.06
174.8394318	0.56
177.1366882	0.66
178.2790375	0.12
179.7925110	0.02
182.1271515	0.15
189.0789948	0.03
190.1541138	0.13
194.3557892	0.08
196.1927643	0.25
198.1580200	0.09
200.0185242	0.10
202.8766174	0.05
206.2730103	0.39
207.2718353	0.05
209.2658691	0.30
210.8861389	0.17
213.2556152	0.03
215.1441345	0.59
216.0612488	0.14
216.8772583	0.10
219.1914062	0.23
221.1502991	0.51
222.0814819	1.02
223.2792358	0.15
224.2880249	0.19
228.1687012	0.11
229.1124573	0.82
230.4554443	0.17
232.8774414	0.64
234.1333618	0.73
235.2084351	11.52
236.1638184	1.18
237.0185852	0.17
238.1061707	0.03
239.2110901	0.23
243.2996521	0.02
247.0090027	0.16
248.0915527	0.05
249.0523987	0.06
250.3231201	0.22
251.0463867	2.35
252.3195801	0.32
253.0607300	0.74
254.1433411	1.29
255.1511230	0.79
256.2108154	0.11
257.1655579	0.14
259.6681213	0.09
262.5625610	100.00
263.5356750	0.60
264.1885986	1.75
265.1564941	1.50
266.1484680	0.80
267.2485657	0.19
269.1133423	0.06
270.9289856	0.26
281.1332703	5.73
282.2919006	0.65
283.1067200	0.64
284.3808594	0.18
285.9849854	0.12
286.6572876	0.07
291.1779785	0.35
292.2646484	0.08
293.1928406	0.39
294.2257996	1.85
295.1406250	0.32
296.5950012	0.03
299.2561035	0.47
303.6659851	0.33
304.7020569	1.15
309.1978760	3.47
310.3107605	0.58
318.7338562	46.66
319.8097534	0.29
327.1800232	0.45
328.0731201	0.09
378.3583984	0.03
388.7369690	0.12
395.4557800	0.19
432.3103638	0.03
489.1528931	0.17
492.3034058	0.08
507.3139038	0.21
508.1634827	0.03
518.1739502	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	291.08
Annotation	N,N'-Ethylenediaminedisuccinic acid
Peak:m/z	Relative Intensity
85.9985962	0.24
115.0562057	0.06
125.1550674	0.22
126.2467651	0.05
127.9454269	100.00
128.9517670	40.39
129.9752960	6.63
153.0594940	3.45
154.0694275	2.93
155.1643066	0.16
159.9828186	2.12
160.9783783	2.05
162.0550842	1.34
171.1331177	3.49
172.1168060	1.73
173.0210876	0.46
175.1496429	0.13
176.1481323	0.21
178.9445953	0.41
180.1725769	0.28
197.0698242	1.26
198.1286926	1.63
199.1198120	0.42
205.2346802	0.04
211.1809387	0.07
215.0889587	6.18
216.1044617	8.71
217.1932068	1.61
228.1083069	0.08
246.9487915	0.29
249.2536621	0.15
254.0644836	2.76
255.0188904	1.66
258.1619263	0.07
271.5289001	6.05
272.1859741	28.96
273.1592407	25.58
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	563.1829
Annotation	Unknow
Peak:m/z	Relative Intensity
162.1930237	0.29
170.0272980	0.19
171.8526611	0.02
182.2197266	0.05
184.2349243	0.03
186.9330597	0.03
202.3858643	0.03
210.0282898	0.10
212.2296448	0.05
213.1777802	0.02
214.2474976	0.08
216.0098877	0.20
223.2763672	0.09
226.1090851	0.04
228.0551758	0.40
233.0564575	0.04
234.2212677	0.03
239.0123444	0.12
242.2685089	0.12
245.3660278	0.03
248.1163635	0.01
250.0289001	0.02
251.2180481	0.35
255.0653534	0.45
256.1065063	3.17
257.9380493	0.03
265.3462524	0.02
271.1247864	0.57
273.1301880	5.32
274.6384277	0.13
277.9873657	0.05
281.7765503	0.04
285.1856079	0.24
288.3335571	0.01
291.1091919	4.73
295.9675903	0.07
303.1495972	1.95
307.2973022	0.10
313.2644653	0.16
315.2377319	0.01
317.0187378	0.05
320.6319580	0.09
324.9497070	0.07
327.3458862	0.03
328.3789673	0.04
331.2424927	0.45
335.2188110	0.06
342.4606323	0.43
343.1604614	0.31
348.3007202	0.05
356.0202026	0.06
358.9914551	0.27
360.3079224	0.15
366.2750854	0.08
371.0657959	0.18
376.2945557	0.15
377.1289062	0.64
388.3300781	0.23
394.1746216	3.14
396.3663940	0.09
398.9221191	0.18
400.4551392	0.04
401.3712769	0.06
402.1593018	0.31
416.3167725	1.35
417.0928345	3.33
418.5001831	0.11
419.3694458	0.03
422.2991333	0.09
434.1407471	100.00
434.8444214	0.08
442.5494385	0.08
444.3756104	0.03
447.4456177	0.02
453.0975952	0.03
455.0658569	0.03
462.5269165	0.02
471.0013428	0.28
472.6631470	0.52
473.5154419	0.05
482.3572388	0.26
483.2352905	0.05
487.2625122	0.09
489.1455688	0.26
498.3861084	0.03
500.2025757	0.23
501.4511108	0.03
504.4736938	0.08
505.1976929	0.05
506.0824585	0.02
517.2565918	0.18
518.2003784	0.13
527.1834106	0.36
530.2849121	0.04
544.5723267	0.45
545.2780762	2.70
546.3792114	0.10
547.8285522	0.13
553.4986572	0.12
554.7876587	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	279.1002
Annotation	Methionyl-Glutamate
Peak:m/z	Relative Intensity
84.0133133	0.06
86.9297180	0.18
102.1030731	0.10
103.8678131	6.07
104.8184357	0.02
129.9969177	0.29
132.8962402	18.60
148.0162354	0.49
149.9683228	100.00
204.7965393	0.14
206.8983765	0.02
216.0517883	1.53
230.9111328	0.02
232.4685669	0.10
261.1080322	1.95
262.0637207	6.94
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	517.16
Annotation	Unknow
Peak:m/z	Relative Intensity
161.0383911	0.06
163.0019836	5.07
174.9457092	0.15
190.8746338	0.43
193.1514282	0.26
205.2047577	0.17
211.1592560	0.09
233.2926483	0.10
234.7964630	0.55
239.2904510	0.09
265.2015381	0.92
270.0799561	0.08
272.9140625	0.40
289.3796997	0.10
291.0138550	0.13
295.0350952	0.13
303.2493896	0.29
307.2355347	1.05
325.0308838	1.34
330.0543213	0.21
335.3210449	0.11
339.1108398	0.19
343.1760864	0.11
349.5608521	0.07
355.2854614	0.26
369.4403076	0.70
370.4974976	0.25
382.3710327	0.15
386.4754028	0.08
387.2981567	0.12
388.6213989	0.10
393.2167969	0.63
395.3643799	0.22
404.9555664	0.45
412.3248291	0.27
413.0102539	0.05
419.0157471	0.12
421.3877563	0.18
427.0313721	0.23
428.5661011	0.15
432.2810669	0.16
436.2661133	0.10
437.0161743	0.65
463.0986938	0.09
471.0855103	100.00
471.8726196	0.30
473.3265991	0.20
476.2557373	0.53
480.1801147	0.04
497.2810059	0.06
498.2656250	2.29
499.3362427	1.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	261.1438
Annotation	Leucyl-Glutamate
Peak:m/z	Relative Intensity
83.9013672	0.26
85.9973450	22.78
129.9701080	0.45
131.9537811	100.00
132.7910767	0.07
147.9973602	1.19
150.1264648	0.04
198.1026459	4.68
215.1272736	0.75
225.1662140	0.18
243.0822906	6.68
244.2258759	30.65
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	539.13
Annotation	Unknow
Peak:m/z	Relative Intensity
168.1940613	0.37
170.0608063	0.33
180.9942627	0.24
184.8896179	0.14
192.1217194	0.27
199.1079407	0.50
203.3607941	0.18
214.0950623	0.07
217.1160889	0.13
219.0601501	0.31
230.4325714	0.07
231.0388947	0.09
233.1078796	0.39
235.1532898	0.09
236.1710358	0.12
237.1880798	0.17
245.0561829	0.05
247.2576599	0.23
249.0381775	0.15
251.0442352	0.51
253.8764191	0.10
262.2708435	0.09
268.3114929	0.11
270.0178833	0.10
272.1522217	0.11
273.0213013	0.22
275.1702881	0.18
280.9428101	0.35
286.8221436	0.18
288.3343506	0.23
299.2461548	0.10
300.2183228	0.43
302.3390503	0.13
303.4422607	0.24
305.0163574	0.77
307.4373169	0.15
316.0039673	0.72
319.9854736	3.50
323.8605347	0.55
331.3082886	0.18
332.0289917	0.09
333.3874512	0.10
335.1625977	0.29
337.1711426	0.18
343.1377563	0.17
346.0732422	0.74
348.1308594	0.17
352.1168823	1.34
356.1899414	1.20
358.2575684	0.09
361.4078369	0.12
362.1742554	1.28
371.3418579	0.32
374.1384277	2.74
375.0683594	0.06
376.2125854	1.73
377.1705322	0.90
378.2106934	0.51
381.4733887	0.29
385.1618652	0.18
388.2018433	0.34
390.0023193	0.13
391.1029053	0.07
392.0372925	0.13
401.3786621	0.10
402.7428589	0.30
404.4583130	0.29
406.1165771	6.89
407.2750854	0.22
408.2201538	0.36
409.6078491	0.86
410.2227173	7.07
412.8535767	0.12
413.4577637	0.24
415.0987549	0.23
423.9666748	0.16
431.0582886	1.40
432.3883057	0.20
433.1117554	0.13
436.1289062	0.21
438.9859619	0.64
440.2695923	0.44
445.2158203	0.65
445.9078369	0.48
446.9483032	1.23
449.1127319	100.00
449.8607178	0.12
451.7153931	0.12
452.9836426	0.09
457.2883301	0.15
459.3058472	0.06
463.2641602	1.00
464.1572266	8.02
465.0366821	0.59
466.2258301	0.49
468.2124023	0.15
475.2903442	0.31
481.2218018	26.75
483.2975464	0.20
486.1469116	0.44
492.5517578	0.54
493.2760010	0.08
498.1071167	3.66
501.9057617	0.49
503.1596069	0.14
505.1209106	0.30
506.1637573	0.11
510.8305664	0.12
520.3330078	1.99
521.3082886	5.26
522.0977173	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	581.1927
Annotation	N-gamma-Glutamyl-S-allylcysteine
Peak:m/z	Relative Intensity
198.9564362	0.01
201.8592224	0.01
209.9828491	0.11
212.9840393	0.02
226.9763336	0.03
227.9280853	0.20
231.9989624	0.10
249.1710663	0.03
256.2190857	0.03
273.1705322	0.14
274.1608582	0.77
291.0761108	100.00
291.6923828	0.26
346.0228882	0.02
449.4109497	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	561.1696
Annotation	Unknow
Peak:m/z	Relative Intensity
163.1669312	0.92
167.1830139	0.13
171.2651062	0.48
172.0865479	0.06
178.1318054	0.10
179.1930237	1.53
188.1367188	0.03
197.0108032	6.22
198.3398743	0.37
204.9537964	0.09
214.4181061	0.04
222.1172180	0.50
223.3381653	0.09
234.4336243	0.13
235.1855927	0.04
238.2630005	0.28
239.1418304	0.27
240.2397461	1.75
242.1407471	0.11
244.0587921	0.60
252.8951416	0.05
261.9158325	0.37
264.5292358	0.43
265.9743347	1.37
268.7961426	0.04
271.1743164	6.55
280.1575317	2.79
282.3412476	0.22
284.1151733	0.71
287.3518982	0.15
289.1777954	0.50
292.1389160	0.05
307.2907715	0.58
308.1672974	0.60
314.2138672	0.40
322.2904663	0.05
324.5535278	0.63
325.2300415	3.97
326.0285645	1.30
330.1306763	0.13
334.2003784	0.07
340.2093506	1.09
351.2932129	1.58
352.4309692	0.10
356.1989746	0.21
358.1770020	4.05
363.4580688	0.07
369.0867920	3.16
377.2039795	0.19
382.3501587	0.28
394.1850586	0.60
395.2221069	1.34
399.2958984	6.37
400.1321411	1.63
407.5696411	0.15
413.2532349	2.88
414.0662842	0.69
422.9548950	0.04
425.3071289	4.09
427.3468628	0.10
432.1430054	3.21
436.3097534	0.12
440.2648315	0.33
443.2638550	15.83
451.2584839	0.53
457.2020874	0.04
466.1219482	0.03
469.2520142	14.69
470.3532715	0.49
471.1304321	0.08
473.6602173	0.19
478.3834839	0.14
487.2821045	100.00
488.3421631	0.06
489.3858032	0.14
492.2438354	0.10
498.1487427	0.24
499.2586060	0.17
500.3983765	0.04
501.2095337	0.16
512.2910156	0.04
514.2432251	0.05
515.0604858	0.44
516.3035278	0.54
517.2586670	0.30
519.3124390	0.18
520.1052856	0.34
523.3528442	1.11
524.3613892	0.72
525.3103638	1.62
530.4014282	0.07
541.3894043	0.19
543.2528687	33.29
544.1224976	0.05
552.0260010	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0853
Annotation	6-Methylflavonol
Peak:m/z	Relative Intensity
81.24909973	0.34
96.14421082	0.19
103.0137482	0.23
104.0069275	0.67
105.9621582	0.15
108.7137451	0.10
112.9780273	0.16
118.961853	0.24
121.2847595	0.18
129.0319672	3.46
130.0024567	2.21
142.1319275	0.09
147.1603241	0.09
150.9419098	23.13
151.9304199	12.19
153.0796204	1.02
154.0470734	0.10
155.0700684	0.17
166.1567078	0.61
166.9264221	0.19
167.9054565	0.26
169.0090942	0.41
170.1381683	0.30
178.0416718	0.41
180.0008087	0.42
181.8864594	0.13
184.1079865	0.65
186.1596527	0.48
197.2340851	0.41
198.0162506	0.70
207.0406494	0.09
208.0861664	0.48
208.8423004	0.50
210.2181396	1.08
212.2054291	0.60
213.1793213	0.40
225.0678253	0.99
226.0686646	2.48
227.212265	0.35
235.5834503	0.17
236.3018646	1.07
237.0632324	0.17
238.1211395	3.40
239.0151978	5.33
250.9229126	1.43
253.0779419	100.00
254.1498566	35.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	355.0984
Annotation	Entadamide C
Peak:m/z	Relative Intensity
114.1193390	0.05
119.8987656	0.23
122.1269913	0.01
124.8053284	0.12
131.9087982	0.07
136.2604980	0.06
136.9932556	0.04
142.0929871	0.03
142.8950958	0.35
159.9392395	0.05
161.0350952	0.06
176.0833130	0.01
178.0122375	100.00
207.0209351	0.02
268.2341614	0.02
297.1044922	0.56
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	517.1922
Annotation	Jioglutoside B
Peak:m/z	Relative Intensity
145.1902466	0.14
162.9125214	9.78
185.0742950	0.04
186.9569092	0.20
204.9065704	0.16
215.1353149	0.15
234.7140045	0.17
247.0938110	1.94
289.0827026	0.70
294.0393677	0.07
307.0700073	100.00
326.8689575	0.05
337.2897949	0.04
367.8233032	0.04
388.2085571	0.05
393.2443237	0.20
395.2412109	0.05
399.2619629	0.70
416.3701172	0.07
422.2470093	0.10
427.1461792	0.10
469.2468262	0.04
470.7446899	17.42
471.4818726	0.71
473.2523804	0.05
474.4805908	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	261.1438
Annotation	Leucyl-Glutamate
Peak:m/z	Relative Intensity
76.8310699	0.07
78.9551086	0.03
85.9719696	22.22
111.8432770	0.14
114.8928528	0.36
119.8110962	0.13
121.2635498	0.10
130.0337677	1.12
130.6780701	0.03
131.9993439	100.00
140.8442688	0.13
143.8803558	0.09
148.1256256	0.52
149.0231781	0.08
149.9024200	0.07
154.9974823	0.02
160.8308868	0.04
172.0987244	0.03
188.0210266	0.14
196.9895782	0.02
198.0290070	5.61
207.2365265	0.15
215.0630341	0.96
217.0716705	0.21
219.9080505	0.33
225.1206665	0.61
228.1824341	0.10
233.1233978	0.24
237.8690033	0.15
243.0760040	8.11
244.1124115	32.24
246.0264740	0.06
246.7714691	0.23
251.6941986	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	261.15
Annotation	Cordiaquinol J
Peak:m/z	Relative Intensity
84.95746613	0.19
92.87950897	0.19
109.03862	0.26
142.8998413	0.19
146.9872894	0.10
149.2773132	0.13
151.1277008	0.42
159.2354889	0.09
173.2810822	0.09
176.057663	0.17
176.8018036	0.10
181.0577545	0.25
184.446579	0.14
188.2194366	0.05
197.2823486	0.14
199.2078094	0.37
214.8864136	9.76
215.9104156	0.10
217.0339355	3.62
218.0329742	0.57
219.3041687	0.25
222.9547119	0.13
225.1893005	0.90
227.104599	0.51
232.9133453	0.41
243.1436768	100.00
244.1324005	0.32
245.2487946	3.42
260.9177856	0.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	507.1568
Annotation	Unknow
Peak:m/z	Relative Intensity
147.0088654	0.36
164.9564514	100.00
252.0602570	0.13
341.1072998	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.0714
Annotation	Deoxyinosine
Peak:m/z	Relative Intensity
97.17415619	0.47
122.896347	1.64
126.1885376	1.67
149.0765533	1.87
161.2019043	0.64
169.5224609	0.95
193.1404266	2.22
205.2709808	3.52
207.218277	5.52
207.9954987	3.18
209.1419373	4.34
211.1966553	0.82
212.9756165	1.89
213.8908234	0.64
214.8899078	0.54
221.1575775	1.36
222.0805817	9.53
223.1608887	20.51
224.1839905	0.46
231.1870728	1.35
233.1973267	3.40
236.2018585	0.36
251.0836792	100.00
252.2292633	17.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	311.1229
Annotation	Tyrosyl-Glutamate
Peak:m/z	Relative Intensity
90.9822235	0.04
119.0223160	0.17
122.9371338	0.46
130.1719208	0.05
136.0520935	5.89
137.1185150	0.01
147.0532990	0.97
147.8977356	0.05
165.0597534	18.68
179.0944672	0.01
182.0850830	100.00
202.2326355	0.04
220.2418823	0.02
247.5202637	0.18
248.1410828	0.95
263.5780029	0.01
264.7637634	0.17
275.1574097	0.48
283.0074768	0.01
293.0538635	1.62
294.1746826	6.65
302.1374512	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	332.1331
Annotation	5'-O-beta-D-Glucosylpyridoxine
Peak:m/z	Relative Intensity
105.9590607	0.03
107.9572601	1.60
123.1589661	0.03
124.1595383	0.14
134.0491333	0.88
135.9110260	1.67
144.9859314	0.08
150.0634766	0.09
152.0359497	6.61
154.1887817	0.03
162.0321655	0.02
170.0209351	7.65
185.9918671	0.03
205.9772949	0.02
232.1702271	0.05
250.2034912	0.03
252.3053894	0.02
278.0837708	0.08
288.3123169	0.02
296.1411438	0.20
314.1636353	100.00
314.7718506	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	531.1602
Annotation	Unknow
Peak:m/z	Relative Intensity
152.4758759	0.30
203.0503540	0.11
212.8413086	0.04
220.0725861	0.20
254.0478516	1.17
263.0651245	0.09
272.9291992	0.11
284.0307617	0.64
287.1071472	0.24
317.2598877	0.20
323.9406738	0.09
325.0933838	0.42
327.3640137	0.07
331.3359375	0.14
346.1580200	0.05
366.1968994	1.55
400.0198364	0.35
424.5402832	0.11
441.0708618	1.55
445.2238159	0.04
447.1757812	0.39
459.2117920	0.22
469.1123657	0.37
470.9041138	0.17
472.1398315	0.09
487.2836304	1.20
490.0249634	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3alpha,5beta,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
104.9403534	0.37
106.8720551	0.66
109.1118927	1.35
116.9501877	0.40
117.9620514	0.07
119.1268539	0.35
120.9712982	2.86
122.9053345	0.95
128.9841614	0.46
130.9262543	0.34
133.2403717	0.13
134.9357605	1.04
136.9775543	0.53
141.1259003	0.24
143.122345	1.08
145.1659851	0.41
146.9932861	2.09
149.0650787	1.35
151.135376	0.75
156.4298553	0.67
157.1116333	1.94
158.9731598	0.11
161.046814	2.71
163.0829773	1.49
165.1101074	0.59
166.9661102	0.81
169.0308533	0.44
173.0143585	1.92
175.0257874	1.75
177.0168457	1.84
180.9738159	0.11
182.998764	0.64
183.9779816	0.80
187.1950378	0.95
189.1706238	0.64
191.1031952	0.49
194.9244995	1.00
197.19664	0.76
200.9990234	0.11
202.7849426	0.80
203.5592804	0.16
205.3039856	0.83
206.2674713	0.51
207.0941162	0.15
209.0461121	0.08
211.0426331	1.59
212.1368103	0.27
213.2731018	0.68
215.2060242	1.18
217.2938232	0.61
227.0424805	0.51
228.1302795	0.06
231.0337524	0.78
234.4897461	0.26
235.2838135	0.50
239.2795105	0.07
243.4327087	0.14
245.1311646	2.01
247.3675842	3.84
249.0540771	0.22
251.2004395	0.88
257.2277832	1.14
265.0510864	0.30
266.9644775	0.95
267.6903687	0.11
271.1283875	1.83
273.7119751	0.06
277.0233459	0.56
281.289917	1.07
283.0046997	0.99
285.3965454	1.74
287.4977417	0.31
294.4436035	0.49
295.3294067	0.40
297.3272705	1.46
299.3731995	1.99
300.2171936	0.34
301.0828552	0.16
305.2992249	3.18
309.097168	0.15
311.1488037	0.67
317.9946594	0.36
321.2497864	0.46
323.2429199	100.00
324.094635	0.47
325.260498	0.35
332.368042	1.11
340.7276611	0.71
341.3424072	1.41
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	179.06
Annotation	D-Hamamelose
Peak:m/z	Relative Intensity
59.0629425	0.58
70.9616928	2.85
72.8892746	0.93
74.9274979	19.55
80.9635315	7.85
86.8808594	3.76
88.8018570	1.59
92.0639343	0.06
96.9968567	0.79
98.9968262	25.77
103.0034485	0.10
106.5819855	0.09
113.2904510	0.09
114.8995056	0.38
117.0304565	0.66
119.0893707	0.04
124.9979858	7.14
129.0184784	0.08
130.9145660	0.25
132.9758301	0.59
135.1237793	0.06
143.0291138	77.70
160.9964752	100.00
179.0518799	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	358.1248
Annotation	Unknow
Peak:m/z	Relative Intensity
109.9136047	10.18
111.1133423	0.08
112.0685654	0.03
114.9174042	0.04
116.0704498	0.05
116.8361130	0.02
119.0317612	0.11
120.8922806	0.06
124.8713608	0.02
129.0303650	0.15
131.0476379	0.04
137.1019287	0.07
138.1579895	0.08
139.0415192	0.11
143.0827026	0.01
145.0409698	0.05
147.0887451	0.02
151.1198730	0.22
155.9816437	100.00
160.0859528	0.01
161.1425171	0.10
169.0593719	0.07
185.0118561	0.23
188.1786194	0.06
203.0356903	4.96
206.1355591	0.15
220.1501770	0.05
227.2535706	0.08
228.1062012	2.04
234.1817932	0.50
235.0330811	0.05
236.2625427	0.03
237.0132446	0.01
241.1317749	0.04
252.1127625	0.35
253.0472717	0.03
265.8586426	0.05
267.0768433	0.22
268.0331421	0.17
271.1226807	0.02
278.1853027	0.04
283.4378662	0.24
284.6190491	0.12
286.2210693	0.01
287.4731750	0.05
294.1741028	0.02
295.2073059	0.01
299.2342529	0.02
301.3716431	0.02
310.9559326	0.06
312.0650330	0.06
312.7107544	0.04
314.2295532	0.16
316.1959229	0.04
321.7841797	0.08
323.3071289	0.06
335.2343750	0.11
340.2051697	4.50
341.2452087	0.12
349.3594360	0.17
358.4429626	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	495.13
Annotation	Methylinoscavin B
Peak:m/z	Relative Intensity
166.0735931	0.64
182.0520630	0.03
184.2020721	0.01
201.1385803	0.03
207.9945679	0.04
210.2013702	0.03
218.1958923	0.03
227.2407990	0.06
231.0686493	0.04
245.3388062	0.01
247.1494141	0.03
261.1304016	0.01
267.0083618	0.02
272.2023621	0.02
278.9427185	0.05
285.1699219	0.01
295.1460876	0.04
303.2210693	0.21
304.2357788	0.06
307.4240723	0.04
309.2634277	0.04
318.4123535	0.02
320.9046021	0.03
324.2156982	0.09
333.0952148	0.05
342.3916016	0.07
353.1062012	0.02
358.0935059	0.02
364.1984253	0.07
365.2174683	0.03
365.9848022	0.03
367.9782104	0.02
370.1233521	0.05
371.3710327	0.03
372.1300964	0.06
373.5845337	0.04
378.0760498	0.10
379.2384949	0.09
384.2074890	0.04
388.2627258	0.14
389.2331238	0.06
393.3882446	0.02
399.1663818	0.03
401.0416565	0.13
403.4339905	0.07
405.1928406	0.03
406.4588318	0.04
407.3645935	0.04
414.4155579	0.03
421.3337708	0.11
422.1619263	0.05
429.2835388	0.02
431.1191711	0.05
433.1235657	0.02
436.3264771	0.03
437.0485840	0.05
441.4697571	0.01
449.1460571	100.00
450.3116455	0.09
451.3368225	0.08
453.1849976	0.03
456.3060913	0.03
458.1450500	0.50
459.2192078	0.13
465.9591064	0.04
467.3941040	0.03
474.9795532	0.05
476.1178284	1.87
477.2167664	0.47
480.3400574	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	287.1596
Annotation	Abacavir
Peak:m/z	Relative Intensity
83.9226990	0.27
90.8935547	0.09
92.9387054	0.09
95.0001678	1.64
112.0912170	22.71
112.9753876	1.02
123.1657791	0.35
130.1682434	1.14
138.9947510	0.02
140.2777100	0.17
148.0040283	0.58
152.1846771	0.04
152.9381104	0.05
158.0456848	100.00
159.2065277	0.06
160.9561310	0.03
178.1755676	0.24
180.1225739	0.02
187.0917816	0.03
193.2963867	0.34
196.0082092	0.10
197.2330322	0.20
198.2031250	0.06
206.3996277	0.12
207.0338440	0.08
216.0633850	0.17
222.1187439	0.04
224.1354370	3.52
231.1448364	0.05
241.0278320	0.41
246.1103210	0.10
249.7710571	0.04
251.1590576	0.48
252.0985107	0.15
255.3878784	0.13
264.1035767	0.09
265.8882141	0.02
269.0828857	4.86
270.1416626	15.68
281.2923279	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	641.1694
Annotation	Nervilifordin C
Peak:m/z	Relative Intensity
240.3506470	0.04
251.2451782	0.12
302.2487488	0.07
310.7542419	0.33
313.4747620	0.04
317.0780029	18.09
326.1408081	0.05
335.2935486	0.18
356.8800049	0.23
359.0838013	0.42
359.7313232	0.06
381.8125610	0.45
389.3198853	0.20
406.0491333	0.08
409.0887451	0.09
416.3159180	0.11
419.9605103	0.07
425.2132568	0.12
430.2090454	0.08
435.4786377	0.06
439.9256592	0.18
441.1505737	0.13
442.3441162	0.13
443.4899292	0.11
456.4114380	0.06
460.5692749	0.27
461.2937622	0.67
463.4432983	0.30
464.1595459	0.15
479.0940552	100.00
479.7548828	0.20
488.7855225	0.04
490.2794189	0.17
494.5496216	0.08
505.9287720	0.10
511.4881592	0.06
519.1649170	0.11
527.1045532	0.19
532.2070312	0.07
536.0676270	0.08
543.3887329	0.08
550.6264038	0.20
561.4113770	0.08
564.3427124	0.26
583.0910034	0.05
595.6340942	1.08
608.4222412	0.27
622.3643188	0.98
623.3288574	0.60
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	272.0889
Annotation	Unknow
Peak:m/z	Relative Intensity
86.0167999	0.32
99.0435028	0.45
125.0849304	0.05
126.8402405	0.09
127.9702301	18.35
129.5785675	0.11
135.3404236	0.11
141.0462494	0.06
143.0887604	23.34
143.9674072	0.05
145.2043457	1.66
146.0785065	2.97
153.1539764	0.03
162.1671600	0.03
166.1313477	0.40
167.1620789	1.09
171.2734833	0.18
172.3291779	0.12
179.0810394	23.58
183.0275726	0.12
184.0009003	0.06
185.1442413	1.96
192.0898285	0.15
193.0073090	0.07
196.0043640	0.14
197.1430511	2.26
199.4154816	0.07
210.0862885	12.34
210.9998016	0.05
221.1830597	0.06
225.2036896	0.13
228.1100616	1.14
236.0789185	0.29
242.2757416	0.17
254.1005402	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	164.0716
Annotation	phenylalanine
Peak:m/z	Relative Intensity
71.98295593	3.00
91.11161041	0.11
92.07926941	0.10
103.0831757	0.09
120.1425781	0.08
127.9169464	0.03
147.0357208	100.00
148.859375	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	234.1232
Annotation	Unknow
Peak:m/z	Relative Intensity
89.8630829	0.01
95.2113037	0.01
96.1443481	0.01
102.1583557	0.06
108.8745270	0.06
110.0917969	0.02
111.7904205	0.14
119.0311127	0.07
121.9315643	0.03
123.9474182	0.01
126.7644806	0.04
136.1495209	0.06
138.0982513	0.02
145.2505341	0.02
146.0811615	0.04
153.0445099	0.01
154.3004608	0.02
175.2345428	0.01
186.0183105	0.05
188.1887665	0.14
190.0767365	100.00
190.9317780	0.00
192.0865631	0.07
193.0020752	0.04
193.8890076	0.01
198.8236084	0.17
204.0241852	0.04
206.1089020	0.05
211.0386353	0.02
216.0294800	0.15
217.0148010	0.16
219.0977325	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	450.1352
Annotation	Unknow
Peak:m/z	Relative Intensity
129.0965271	0.01
144.0120239	0.14
145.3683777	0.06
160.2341614	0.08
170.0059052	0.15
184.9316406	0.05
189.0974121	0.04
191.1290283	0.30
212.9915314	0.05
214.0690918	0.77
227.3225403	0.05
229.1065674	0.02
231.0997314	13.41
233.1104584	0.72
244.0768433	0.08
244.8201599	0.09
246.2009583	0.37
249.0598450	0.46
255.1251831	0.04
258.9767151	0.03
262.9606018	0.92
268.0872498	0.21
273.1733398	4.32
281.0852661	0.05
286.1400146	0.08
287.2702026	0.05
303.6244507	0.02
304.3604431	0.04
305.3005676	0.03
316.2836304	0.02
318.3991699	0.07
321.0633240	7.12
342.1207581	1.34
360.1166687	100.00
374.1155701	0.02
387.3095093	0.02
392.1529846	3.46
409.1524963	3.04
432.0106506	1.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	842.26
Annotation	Unknow
Peak:m/z	Relative Intensity
340.8089600	0.13
383.4340820	0.25
442.2035522	0.22
485.4716797	0.08
661.2890015	0.19
665.2961426	100.00
665.9489136	0.41
691.2685547	0.28
784.2199707	0.28
797.0681152	0.36
800.9979858	3.95
818.2724609	0.51
819.0727539	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1087.2964
Annotation	Unknow
Peak:m/z	Relative Intensity
323.2611694	0.09
341.1618958	0.02
383.2240601	0.50
413.1306763	0.08
421.0364075	0.02
502.7265625	0.04
601.1786499	0.06
647.3468018	0.58
665.2391968	0.38
707.3372803	0.39
745.5422363	0.10
763.4321289	0.12
797.1245117	0.09
809.2052002	0.23
827.4459229	0.40
907.3366699	0.24
925.1857910	0.31
970.2033691	0.06
983.3281250	0.05
989.3986816	100.00
1069.3579100	8.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3alpha,5beta,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
97.03676605	0.10
98.89648438	0.17
100.8658371	0.23
107.0213318	0.97
108.9766617	1.55
112.854538	2.16
114.9459839	0.60
116.8935928	0.16
121.0283813	2.33
122.9303284	0.07
126.1841507	0.27
127.156517	0.14
128.9658508	0.52
131.0723877	2.72
132.924408	0.68
135.0123901	4.71
136.0955963	0.06
137.0524292	0.55
142.9781189	1.73
144.5653076	0.47
145.2586517	0.13
146.9549866	1.25
148.9916229	2.40
150.0794067	0.13
150.9268188	0.71
153.0017395	0.09
157.0358582	1.58
159.0892029	0.65
160.8198395	1.23
163.0273132	3.34
164.9961853	0.34
167.130127	0.47
168.9685974	0.71
171.1383057	0.49
173.102417	1.73
175.1522827	0.88
177.0465088	0.61
179.3357086	0.35
183.1251221	0.46
185.1000061	0.32
187.0176239	2.36
189.0459595	0.98
190.9064941	0.73
192.7993927	0.36
194.7878113	0.34
197.1913757	0.18
199.1084442	0.07
200.1100006	0.18
201.2120667	0.94
203.0448303	1.13
205.1239014	1.06
206.8201447	0.21
209.3666382	0.31
210.8135986	0.94
211.562561	0.22
213.1440125	0.38
214.9064026	0.07
216.106781	0.09
217.0686646	0.83
219.0559082	0.78
223.3167419	1.13
225.1547241	0.45
226.2112122	0.11
227.2182312	0.64
229.3125305	0.47
231.1182251	5.51
233.2283325	0.13
234.5008545	0.58
235.3037109	0.56
236.0540161	0.59
239.4376831	0.52
243.223999	0.67
245.1141663	2.36
246.229187	0.06
247.2256165	11.01
248.8651428	0.33
250.9823303	1.39
253.4131775	0.35
255.1950073	0.32
259.0220947	1.46
266.9110413	3.24
267.549469	0.24
269.1503906	0.17
271.1495056	0.85
277.0168457	0.12
281.2374878	0.10
283.184021	0.36
285.3355408	0.41
287.4063416	0.29
288.2157593	0.62
295.30896	0.95
299.1578979	3.87
303.0919495	0.31
305.235321	4.37
306.2225037	0.55
310.3089294	0.31
320.818573	0.31
322.114624	0.24
323.2443237	100.00
323.8950195	0.89
332.7913208	0.27
341.4113464	1.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	457.1198
Annotation	12-chloroisoplagiochin D
Peak:m/z	Relative Intensity
143.0242462	0.11
160.7883453	0.14
176.8909149	0.16
178.9460144	1.17
207.0775452	0.07
224.0076599	0.21
257.0344849	0.07
295.2453918	0.62
341.2290649	100.00
395.7091370	0.09
397.1647644	0.34
411.0742493	0.41
423.4298096	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	199.99
Annotation	Unknow
Peak:m/z	Relative Intensity
59.8070908	0.06
68.8694763	0.19
71.9362640	0.09
73.0019836	0.17
73.7998047	0.20
79.0850525	0.16
80.9572220	0.10
81.9248276	0.19
82.9115295	0.67
84.0462494	0.12
85.7466888	0.39
87.3011627	0.30
87.9033890	0.22
89.9567413	0.11
93.0614166	0.08
95.0245209	0.28
96.2203827	0.45
97.0558014	0.20
97.9771729	0.43
99.8479462	0.05
103.2230835	0.05
106.1694183	0.03
107.9891815	0.20
108.8244629	0.12
110.8357086	0.30
112.0451660	0.37
113.8536835	0.99
121.7903900	0.36
124.0206299	0.40
126.0338898	0.22
127.9396362	0.09
128.8944855	0.14
129.9819489	0.27
133.2907715	0.29
133.9331512	0.03
138.1959686	0.39
141.7089996	0.09
148.9906464	0.23
151.8959656	1.56
154.0099945	3.85
155.8025055	0.55
157.1950836	0.10
158.8336639	100.00
163.0393829	0.25
164.0405579	0.15
167.9583588	0.21
171.0660553	0.14
172.0805664	0.46
176.8218384	1.80
178.9770203	0.06
182.0527191	2.19
182.8965302	0.53
185.3628540	0.44
191.3499756	0.68
194.3827515	0.04
199.9775391	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	350.0551
Annotation	Unknow
Peak:m/z	Relative Intensity
127.9578476	0.06
131.1078033	0.07
135.9442444	0.92
156.1179504	0.16
172.0712280	0.05
173.1354523	0.95
176.1124725	0.10
188.2093201	0.56
198.1470032	0.16
222.0758667	0.20
224.1206970	0.08
230.1523743	0.55
241.8849792	0.07
256.1129761	0.18
257.8251343	0.16
260.0462952	0.34
262.1527100	0.35
262.9698792	0.10
269.9987793	1.67
274.0464478	3.33
278.0501404	0.29
288.0835266	0.09
290.0006104	0.08
290.9950562	1.88
292.0585022	2.37
304.2128906	0.62
306.1950684	0.06
309.0620728	0.57
314.1261902	0.35
322.7010498	0.08
332.0050964	100.00
332.6089478	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	421.16
Annotation	Unknow
Peak:m/z	Relative Intensity
121.9750290	0.19
123.2056656	0.11
133.9183044	0.19
137.0428009	0.35
138.1525421	0.71
140.2093658	0.36
150.9896851	0.93
152.0675049	1.89
153.0153809	0.98
162.2687683	0.78
164.0695190	2.12
166.8921814	0.22
172.8065491	0.19
174.1512756	0.34
175.4673004	0.17
178.9560242	0.31
186.0703430	0.71
196.2199402	0.16
210.5710754	0.49
224.3069763	0.19
227.1698761	0.11
229.0744019	0.28
232.0518494	0.15
236.8374634	0.06
240.6467896	0.20
242.7389221	0.17
254.3167725	0.18
257.2517395	0.09
258.3917847	0.42
259.2511292	0.34
270.0455322	3.71
273.3323364	0.14
275.1789246	0.51
276.1328430	11.30
278.2268372	0.20
280.1112976	0.47
282.7903442	0.36
297.2600098	1.89
297.9085388	0.27
298.8246765	0.24
302.2178345	0.14
308.0572205	0.20
312.8725891	0.40
315.3589783	1.96
316.2285461	1.76
324.2410583	0.32
327.2077942	0.11
329.3575439	0.28
330.9863892	0.32
333.4674683	0.24
342.0549622	0.08
345.3277588	0.28
346.5546875	0.39
347.2172241	7.34
349.3764648	0.27
353.1650391	0.18
354.3341370	0.46
357.2540588	0.50
362.2779846	0.74
363.3980713	0.13
364.5321350	0.51
375.3102722	0.20
375.9161072	0.42
377.3863220	0.35
380.1454163	100.00
380.8914490	0.60
382.2871399	1.04
386.3380737	0.32
389.0578003	0.09
390.2853088	0.15
391.2946777	0.12
393.1852112	0.09
403.1371460	6.64
404.2449036	0.17
411.8776550	0.75
412.5707703	0.58
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	400.19
Annotation	Unknow
Peak:m/z	Relative Intensity
132.8597565	0.03
146.7648163	0.04
152.0726624	0.07
153.8971558	0.10
161.9796753	0.26
163.9687500	0.03
173.0678711	0.09
178.0673523	0.07
182.1359558	0.04
211.1301270	0.04
215.0366211	0.02
223.0299683	0.08
225.1312866	0.02
226.0782471	0.03
229.4773254	0.04
238.2797546	0.02
239.0241394	0.13
244.0547485	0.24
245.1013489	0.05
255.9840088	0.06
266.4180298	0.08
268.1963196	0.61
269.2741394	0.01
271.1760864	0.06
287.2928772	0.31
293.0316772	0.10
300.6538696	0.08
306.2175598	0.11
308.4622498	0.11
310.2141418	100.00
310.8508301	0.09
325.1309814	0.06
326.4478149	0.05
327.3882446	0.13
336.0848083	0.23
345.5269470	0.05
346.2438049	0.01
351.1256714	0.07
353.0533447	0.06
354.6834106	0.02
356.8603821	0.08
359.2470093	2.62
364.0347595	0.16
368.1727600	0.09
381.3501892	0.06
382.1603088	0.21
383.3675232	0.30
392.2995605	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	579.3882
Annotation	Timosaponin A-I
Peak:m/z	Relative Intensity
167.0287323	0.35
175.1672363	0.04
185.0592346	0.06
191.2426453	0.22
199.0777893	0.32
201.4850464	0.05
204.8891449	0.21
215.3238678	0.04
220.1948853	0.11
223.0755157	0.17
229.1730347	0.15
233.4060669	0.05
241.1547089	0.03
255.2948761	3.80
258.3557739	0.10
259.4096375	0.03
263.1572571	0.09
265.2723083	0.02
266.044342	0.43
269.3635254	0.14
270.5695801	0.31
273.1765137	39.47
281.0778809	0.03
283.392395	0.03
285.1289062	0.56
286.7663574	0.03
289.3210449	0.33
307.0917358	0.08
309.4923706	0.55
310.3031616	0.41
311.3135376	0.30
312.0983276	0.17
313.0548706	0.06
315.1925659	0.29
318.2774048	0.08
321.2280273	0.29
322.0222168	0.10
323.3734131	0.70
324.4458008	0.04
325.6477051	0.22
351.2211304	0.10
357.1794434	0.03
363.4832764	0.10
375.3269653	0.10
381.4639893	0.40
393.2713013	0.16
397.5007324	0.21
399.3016968	0.85
401.2776489	0.03
413.4315796	0.38
415.3952637	0.44
417.3336182	100.00
418.3577271	0.39
425.4346924	0.15
426.8712158	0.04
429.0855713	0.03
435.282959	2.67
441.5283203	0.05
443.1543579	0.11
445.5213013	0.13
451.579895	0.07
459.5535278	0.22
487.6224365	0.26
488.2860718	0.15
489.0626831	0.29
495.6382446	0.10
497.6241455	0.19
503.7554932	0.34
505.3511353	0.06
519.1870728	0.32
526.2375488	0.08
543.2573242	1.90
546.883728	0.05
560.3428955	0.07
561.5425415	2.16
562.7067261	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	316.2839
Annotation	Halisphingosine A
Peak:m/z	Relative Intensity
89.92626953	0.09
93.04782867	0.41
94.99448395	1.67
97.01781464	0.30
104.8866043	0.67
107.0530319	0.62
108.7181778	0.33
111.1623611	0.44
111.9931946	0.09
118.9810562	0.31
121.0709686	1.00
123.0100861	1.05
125.0495071	0.56
126.8829651	0.31
129.8808594	0.13
130.9944458	0.27
132.9969788	1.28
135.1620941	1.22
136.5920868	0.25
137.2031708	0.54
139.2161865	0.17
140.8724976	0.14
141.9096985	0.29
147.0513611	0.73
149.2167969	0.23
150.8927155	0.36
153.0114136	0.24
154.8689575	0.16
155.9251099	0.30
156.5324707	0.16
161.2486877	0.62
163.1351318	0.71
165.0381317	1.48
177.05896	0.38
189.1543732	0.34
191.3690186	0.34
193.6437988	0.29
196.0522156	0.29
203.1167297	0.16
206.436554	0.18
207.3984375	0.10
209.1644287	0.19
211.2201843	0.29
212.8260498	0.24
217.1704712	0.12
218.9945374	1.06
221.2676697	1.64
223.0538025	0.09
225.0125122	0.35
227.1531372	0.22
228.15448	0.16
231.7883606	0.18
233.3397827	1.08
235.3841248	0.30
236.246521	0.35
238.3025208	0.63
239.2634888	2.47
241.2400513	0.10
242.1516418	0.24
245.3551025	2.96
250.1287231	0.78
251.2992249	2.51
252.3580322	0.78
253.3348389	0.31
254.4558411	0.30
255.9176941	0.16
262.3261108	3.82
263.3052673	2.35
267.0276184	0.35
268.316925	3.26
269.2286682	0.06
270.3198547	0.33
272.1373596	0.76
275.1442566	0.35
278.6071777	0.25
280.2824707	51.68
298.2780151	100.00
299.2661743	1.29
300.17099	0.19
302.1855469	0.20
304.3730469	0.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	425.18
Annotation	Crepidiaside B
Peak:m/z	Relative Intensity
131.9590149	0.15
142.1664429	0.06
144.0402222	0.15
149.9995728	1.74
158.9144135	0.04
169.1755066	0.17
170.1737671	0.10
175.9596405	0.04
185.4377441	0.07
201.2483215	0.08
215.2162476	0.04
218.9925537	0.05
228.3210449	0.15
231.0547791	0.04
232.2922974	0.13
245.1982117	0.08
249.1299438	0.14
251.1841736	0.05
252.2016296	0.03
253.0678406	0.25
259.1678772	10.59
260.6110840	0.29
263.0155640	0.39
267.3298950	0.18
269.3244934	0.07
273.9758301	0.20
276.0886841	100.00
277.1354980	0.06
278.3642273	0.16
279.1157532	0.13
281.1997986	6.09
283.3699341	0.02
288.3937378	0.08
290.2764282	0.18
292.3130188	0.03
293.5149536	0.04
296.3002930	0.07
299.4666748	0.04
302.8637085	0.03
307.8098145	0.22
310.2814941	0.10
315.2666626	0.03
316.2435303	0.05
317.0111084	0.23
318.3751526	0.42
319.3377991	0.37
321.3886108	0.30
326.8851624	0.05
335.1599121	3.31
336.1654053	10.90
339.0194702	0.04
342.8178406	0.19
345.0014343	0.04
350.5435486	0.19
361.0094910	0.12
363.6704712	0.25
366.3018188	0.04
370.8318176	0.73
377.1706543	0.05
378.0405884	0.05
379.4774780	0.36
380.2289734	0.14
381.2450256	0.80
384.3367920	0.16
388.3497925	0.12
389.4548035	0.75
390.2733765	0.54
393.1017761	0.27
396.1747742	0.37
402.6778259	0.12
405.5923157	0.55
406.5180969	1.23
407.2602234	2.58
408.1858215	0.97
409.9859924	0.09
415.5961914	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	603.2034
Annotation	Unknow
Peak:m/z	Relative Intensity
211.9776154	0.04
213.2088928	0.06
225.2448273	0.10
251.1837158	0.21
293.3333130	0.10
317.5627441	0.15
325.2158203	0.10
348.1944580	6.62
358.2289429	0.32
359.2073975	0.17
407.3281860	0.74
409.1445923	0.72
417.3377075	1.72
423.3701172	0.08
445.3344116	1.19
452.7237549	0.45
460.0507812	0.20
463.0634155	0.71
473.2062988	0.59
482.5042725	0.36
486.9125366	0.28
489.3342285	0.09
501.3722534	0.19
505.5052490	0.41
506.3282471	4.38
507.3367920	0.51
520.7005005	0.28
521.6318970	1.15
537.4492798	0.56
540.5323486	0.32
549.2319336	0.43
554.8049927	0.95
557.2750854	0.21
558.5236206	0.95
559.5951538	0.72
561.9408569	0.32
565.6331177	0.92
566.8024292	0.61
567.4249268	0.27
568.0578613	0.28
571.2975464	0.31
572.6688232	0.47
573.4680176	0.58
582.9193115	1.15
583.8874512	0.48
586.2991943	100.00
589.1337280	0.26
602.6229858	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	637.1773
Annotation	6-Hydroxyluteolin 6,4'-dimethyl ether 7-rutinoside
Peak:m/z	Relative Intensity
178.9034424	0.28
185.3575439	0.05
193.0105591	1.29
207.0070496	0.10
209.3146515	0.13
215.4861145	0.07
221.3836975	0.29
245.0400085	0.03
248.2852631	0.07
263.0483398	0.44
269.3171387	0.08
281.2503052	0.39
298.8535767	0.13
303.3176880	0.12
323.2848511	0.08
325.0369263	0.10
327.3192749	0.28
330.2887573	0.12
355.3354492	0.08
357.1805420	0.05
363.3455811	0.15
375.0211182	0.49
383.3468018	0.41
392.2684937	0.03
397.1263428	0.05
412.7366333	0.08
425.2215576	0.20
430.2921753	0.17
432.3369751	0.03
439.2860107	0.26
443.1860962	100.00
455.9487305	0.05
457.1351929	0.43
457.7523193	0.10
459.1322021	0.03
469.4138184	0.08
475.2866211	0.65
479.0369263	0.16
482.2232666	0.07
487.1072388	0.06
491.1513672	0.06
493.0072632	0.11
499.2805176	0.50
501.3221436	0.10
505.6076660	0.04
507.0715942	0.34
513.2886963	0.03
517.3484497	0.07
519.2839355	0.06
534.5900269	0.25
537.3235474	0.06
545.0681763	0.09
549.4329224	0.08
550.4558105	0.04
557.0098267	0.08
561.4828491	0.10
563.0609131	0.17
564.9491577	0.03
571.5032349	0.11
574.1458130	0.03
575.3601685	0.09
577.6350708	0.22
579.2341309	1.74
590.4205322	0.11
592.4083862	0.57
593.3583374	0.97
594.3329468	0.07
595.2086792	0.06
596.3856812	0.28
605.4068604	0.11
615.3748779	0.29
616.9385986	0.17
618.1676636	0.30
619.2525024	0.46
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	322.0593
Annotation	Unknow
Peak:m/z	Relative Intensity
97.1520081	0.03
97.9545822	0.14
99.9463119	0.84
102.8418579	0.32
107.9635849	8.22
110.9943466	1.11
126.0085754	67.58
144.9673767	2.40
158.0720215	0.17
169.9469147	0.02
171.1567078	0.06
171.8569641	0.02
189.9023438	1.69
191.9548645	0.38
212.6321716	0.09
213.3489990	0.07
215.8338318	100.00
216.5985718	0.21
219.1946411	0.17
231.3896484	0.47
232.0628052	1.61
248.0122681	0.14
249.9811707	2.04
256.5887451	0.15
263.2861023	0.17
263.9011841	0.28
264.7083130	0.09
275.0621338	0.03
277.1159668	0.15
287.6557617	0.09
290.2025452	0.04
299.7239075	0.06
302.5749817	0.15
303.4445496	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	901.476
Annotation	Neosibiricoside D
Peak:m/z	Relative Intensity
251.134201	0.97
253.2909088	8.33
254.1793976	0.43
271.2564697	21.64
272.0614014	3.16
283.3824463	4.35
288.9571838	0.59
301.0571289	1.09
307.4611206	1.17
318.4310913	0.31
324.6998901	2.13
327.0852356	1.90
333.6495667	0.82
341.7263489	0.74
361.483551	0.51
379.4640808	8.16
380.3205566	3.40
381.6431885	1.38
395.4916382	0.41
397.2525635	29.72
398.2804565	7.56
398.93573	0.75
409.5018921	0.42
411.4155273	3.13
413.1606445	0.69
415.3260498	100.00
416.4625244	26.41
433.0993042	1.24
434.126709	0.81
457.2553101	0.33
522.9362183	2.04
523.9268188	0.41
541.2998047	4.43
542.3918457	1.12
558.3556519	0.36
559.2380981	1.55
560.3284302	2.03
563.4749146	1.10
574.3759766	0.43
576.7698364	11.43
577.3790894	80.41
578.2286377	23.53
578.9018555	0.62
593.3135376	2.69
617.4032593	0.80
707.9020996	0.70
721.406311	1.92
736.7723999	0.89
737.9508667	9.91
738.8359985	4.47
739.4683228	9.54
809.5193481	0.33
817.4724731	0.43
853.4432373	8.91
856.4690552	4.07
858.6978149	0.38
865.4414673	11.81
866.4443359	3.50
881.7043457	0.33
882.5879517	0.41
883.6292114	1.43
884.5567627	1.19
896.5650024	0.58
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	388.0551
Annotation	Unknow
Peak:m/z	Relative Intensity
120.5972977	0.10
130.9815979	0.54
132.7082825	0.10
134.1587372	0.12
137.0530548	0.42
144.2426758	0.12
145.0866394	0.18
146.9892731	0.09
148.0625458	0.31
161.1603394	0.03
162.0766296	0.20
168.7990112	0.33
169.9262390	0.05
182.7947693	0.03
184.1915131	0.07
195.0511780	0.12
202.9783325	0.06
218.9247742	0.18
220.2448883	0.10
234.8925171	0.05
235.8492737	0.14
238.0375366	0.31
239.9476624	0.15
247.3286743	0.15
251.8242493	0.12
253.1509094	0.14
254.6109619	0.03
260.1786499	0.19
262.9297180	0.46
265.2749939	0.10
266.7200012	0.54
267.3582153	0.06
281.1508789	0.47
282.1288757	0.10
283.0290833	0.18
284.9421387	0.03
289.2546387	0.21
292.3259277	0.09
294.3517456	0.10
295.0179749	0.22
297.9527588	0.12
299.2468262	0.07
302.2704468	0.08
305.3710938	0.07
308.2312927	0.20
311.9885254	0.09
312.6093140	0.17
314.2202759	0.10
315.3977356	0.06
321.8061523	0.34
323.6204834	0.15
325.1091614	0.09
327.6973267	0.42
330.8731689	0.22
339.2088318	0.25
341.1403198	0.27
342.3395996	0.10
345.4662781	0.03
346.3883667	0.13
352.3033447	0.60
353.2729797	0.29
356.8890076	100.00
357.5009155	0.21
369.2765198	1.99
370.1354370	0.68
371.1363831	1.03
377.6546631	0.16
387.4675293	0.19
388.5281067	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	542.1457
Annotation	Unknow
Peak:m/z	Relative Intensity
164.1266174	1.42
177.0458984	0.16
178.8868866	0.10
188.0021515	0.79
191.9559326	0.28
196.1728821	0.26
202.1832886	0.33
203.0227509	0.32
206.0447998	0.34
207.9081726	0.64
209.8115082	0.36
226.0717010	3.03
228.1245117	0.05
233.6069794	0.25
238.1329498	13.55
243.0798645	0.14
251.0281372	6.11
256.1305237	6.94
266.2252197	0.23
274.0852356	58.00
277.3341370	0.09
286.1387329	0.06
290.2671509	0.26
296.3441772	0.12
304.2444458	0.70
310.2312012	0.35
315.2196655	0.05
320.0093994	0.26
340.0062866	0.15
340.9388428	0.05
341.6525269	0.17
352.1889648	0.30
359.9496460	0.25
361.3476562	0.44
362.2653809	0.54
366.4659424	0.14
379.1716919	0.41
380.1638794	0.75
390.3641357	0.31
392.1057129	1.28
395.4359131	0.18
407.0816040	0.18
407.8234253	0.18
408.5861206	0.13
411.4603882	0.34
412.2651978	0.81
413.0783081	0.77
416.2175293	0.30
417.3635254	0.37
424.6222534	0.33
430.9370117	0.04
433.2073364	0.14
449.1582031	1.37
450.3125610	1.52
451.1900024	3.72
452.2342529	1.56
456.2089844	0.26
458.2336426	11.13
466.1654663	0.80
467.2111816	0.54
468.4432373	0.49
470.0586548	0.11
477.6502075	0.18
482.9108276	0.64
483.5517578	0.99
484.2008667	0.17
488.2955933	4.38
497.2371826	0.24
500.1033936	0.04
501.4830322	0.35
502.3453369	0.28
505.3883667	1.30
506.1062622	13.86
511.2592163	0.11
520.8345337	0.12
524.0894775	100.00
524.7532349	0.13
527.3425903	0.15
533.9572144	0.49
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1187.3511
Annotation	Cannabisin A
Peak:m/z	Relative Intensity
383.5426331	0.05
421.2541504	0.04
485.0522156	0.01
648.1805420	0.02
665.1976318	0.06
666.3500977	0.27
684.4068604	0.03
810.4606323	0.06
826.9763184	0.04
828.3736572	0.02
846.1354980	0.10
854.2392578	0.04
869.9394531	0.10
870.5620117	0.08
907.4189453	0.02
972.2039795	0.04
989.9923096	0.05
992.4468994	0.02
1026.0982670	0.02
1032.4790040	0.03
1152.3438720	100.00
1153.3759770	1.92
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	311.22
Annotation	trans-EKODE-(E)-Ib
Peak:m/z	Relative Intensity
96.98125458	0.57
98.98042297	0.30
110.8258972	0.20
115.2007904	1.27
123.1727524	1.19
124.9646912	2.68
127.0958099	0.73
133.0575714	2.83
135.0195923	0.97
136.9189453	0.66
139.0769348	0.62
143.0021362	0.27
145.0376282	0.23
147.4607697	2.69
149.1725159	1.20
151.053299	0.43
152.9291687	1.60
154.9796906	1.45
157.1085815	1.13
159.1407166	0.55
161.2037659	1.17
163.3953247	0.34
166.1363525	0.34
166.8115082	2.07
169.1717682	1.07
171.2446899	0.31
175.1880493	0.61
177.1421814	1.85
179.2199097	0.41
181.0918732	0.83
182.0531158	1.86
183.0883789	1.29
185.1397247	0.47
189.1660767	0.20
193.4217682	0.20
195.0539246	2.50
197.431366	0.58
205.1314392	1.13
209.2457275	0.61
211.3638916	0.45
213.288269	1.91
217.2598877	1.59
220.9190674	0.12
222.9138794	1.20
225.1596069	1.27
227.3691406	0.43
228.1257935	0.53
228.9094543	0.21
231.2706909	0.77
233.3272095	0.33
234.9833984	0.61
237.2950745	2.88
239.3068237	2.05
241.2605591	0.71
247.3455505	0.97
249.1713562	0.19
251.1567993	3.30
253.1177063	6.59
255.1556702	1.69
257.3226318	2.38
265.1043091	2.96
266.0476074	0.43
267.1151123	1.44
268.8060303	3.81
269.4701233	0.89
270.1028748	1.67
273.0704346	1.17
275.1965942	16.49
279.3003235	0.77
281.3684692	0.64
283.4013367	4.04
288.5284424	0.79
293.2134399	100.00
294.1375732	2.98
296.8443604	0.89
302.2947388	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	199.99
Annotation	Unknow
Peak:m/z	Relative Intensity
57.9011459	0.06
66.8421783	0.06
68.8512344	0.11
70.9510498	0.11
74.1010284	0.10
78.9711914	0.11
81.0287323	0.28
82.1624985	0.14
83.0226746	0.30
83.8978805	0.33
85.0861206	0.16
87.2652588	0.08
88.0165405	0.08
93.0634918	0.04
94.0947113	0.18
94.9447021	0.07
96.0391540	0.41
97.0075836	0.35
98.1965179	0.11
99.9500427	0.33
108.0448608	0.24
108.9493713	0.12
110.9962921	0.07
112.0791931	0.09
114.1712036	0.11
115.1713409	0.25
115.9884491	0.04
118.9690247	0.04
121.1121979	0.63
122.1267090	0.14
126.0129547	0.12
126.6408386	0.11
129.2646179	0.17
134.1124115	0.06
135.1301117	0.11
136.2001495	0.09
140.2342529	0.08
141.1985474	0.14
142.1161957	0.03
146.5494232	0.37
148.7228851	0.24
154.1660309	0.11
155.9474792	0.25
157.1785583	0.21
158.8749390	100.00
160.8955231	0.03
162.9592133	0.12
164.1127014	0.25
171.3188934	0.13
176.6916656	1.53
181.3469543	0.49
182.0309601	1.09
183.1012268	0.41
185.1338654	0.06
199.7460938	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.09
Annotation	Phenytoin
Peak:m/z	Relative Intensity
81.24047852	5.13
90.63882446	1.88
94.96487427	10.46
97.25761414	0.98
98.96166992	1.74
103.1510925	1.34
105.2154846	2.48
105.9074402	2.11
106.9283447	2.79
109.0205231	2.28
111.082016	2.77
118.841095	2.00
120.9010925	1.80
123.0087585	12.12
126.6860657	2.63
128.9906464	6.46
133.0199585	2.54
133.8012085	1.80
136.9648895	3.87
139.0947723	3.76
141.0526123	2.52
144.9016113	4.84
147.0920258	3.13
147.935257	0.73
149.1903534	1.76
150.8937225	100.00
151.938858	7.47
153.0650482	2.84
154.9328918	1.23
157.0973969	1.28
159.0841827	0.73
160.0366364	2.32
161.0933533	3.87
162.9393158	11.30
165.181076	4.19
166.9925995	11.13
169.0463715	13.88
171.1210175	2.32
173.2142029	0.89
175.0935059	13.57
181.0559235	0.48
182.5568695	4.46
183.3046112	4.68
185.1545258	0.74
186.2050476	1.39
188.7900848	2.60
193.2214813	3.39
193.9991608	4.19
195.2743378	4.53
196.1768341	5.54
196.954483	4.20
199.1083221	6.33
207.1416779	11.78
208.0971527	3.31
209.2293091	6.68
211.2464752	7.73
217.1856384	26.79
225.0814362	29.08
226.4616852	0.81
235.1542969	71.31
237.911377	25.79
239.0655518	3.35
243.4264526	11.06
251.1417084	4.57
253.1013947	92.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	166.0858
Annotation	Gentiatibetine
Peak:m/z	Relative Intensity
106.8397064	0.02
119.9514618	100.00
120.6817322	0.01
130.9187469	0.24
145.2216492	0.01
147.4222870	0.04
148.8655853	5.41
149.5183563	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	682.1346
Annotation	Unknow
Peak:m/z	Relative Intensity
196.2120361	0.07
197.1379700	0.37
208.0603638	0.07
210.2188416	0.14
211.0101013	0.11
215.0339050	0.09
234.1121979	0.05
236.1371765	0.14
249.0922394	0.08
252.1541901	0.22
254.1862640	0.78
262.2905884	0.21
272.0708618	0.16
275.3450317	0.11
280.1923523	0.06
282.1911011	0.26
286.1566162	0.87
286.9301758	0.13
288.2463074	0.45
295.2509460	0.20
298.4243469	0.08
302.9455261	0.27
304.1094971	0.52
311.3824463	0.09
314.1343994	0.03
315.2151489	0.21
320.8354492	0.08
323.1035156	1.49
326.2697144	0.14
327.1420898	0.05
328.5062561	0.06
331.4669800	0.09
332.2088013	0.13
339.2229309	0.57
341.3983765	0.94
350.9711914	0.18
355.0879517	0.49
357.8205566	0.42
359.9097900	1.41
364.1292114	0.10
365.0429077	0.05
366.9393921	0.20
370.2826538	0.06
372.6682129	0.32
373.2897339	1.69
374.7575073	0.10
378.3049927	1.54
380.4432983	0.16
383.2628784	0.58
385.5475464	0.15
387.2094116	0.19
387.8201294	0.02
389.9927979	0.08
396.2520752	0.06
403.7078247	0.03
405.2753906	1.20
406.0685425	0.49
408.5775757	0.54
409.3084106	0.33
412.2134399	0.07
414.2850952	0.31
415.3386841	0.52
417.2650757	0.06
420.2562866	0.16
421.7230835	0.14
422.4400024	0.31
424.2241821	0.39
426.3750000	1.54
427.2530518	0.14
431.9329224	0.50
433.0078125	0.12
434.1124878	0.25
438.2048950	0.23
440.3899536	0.49
446.1320801	0.02
447.1571045	6.43
448.1507568	0.06
450.1849365	0.19
452.3024292	4.81
454.5236206	0.14
456.3637695	0.09
458.3366089	0.75
459.7341919	0.06
461.1174316	0.06
466.2600098	0.39
468.4585571	0.04
470.2237549	7.14
471.2005615	0.75
472.5318604	0.15
473.3677368	0.12
479.1182861	1.97
481.0498657	0.15
484.2006226	4.57
485.3225098	0.12
488.1612549	1.08
489.1929321	2.21
490.1565552	0.57
493.4717407	0.04
494.2723999	0.06
499.5517578	0.03
500.9832764	0.27
502.3333130	6.30
504.2712402	0.04
514.2758179	1.05
515.2802734	1.59
516.3179932	1.28
517.3793335	0.06
518.1956787	0.11
520.0995483	0.15
522.7921143	0.23
528.4750366	0.19
530.0599976	0.20
532.2554321	0.73
534.1779175	6.12
535.4364014	0.40
536.3882446	0.73
540.1915283	1.16
545.1347046	0.08
547.2543335	0.04
553.2162476	2.67
556.1102905	0.22
558.1494751	32.15
558.7561646	0.12
562.7901001	0.07
563.8023682	0.12
568.1558228	2.58
569.3638306	0.10
572.2020874	0.25
574.4677124	0.06
576.3130493	100.00
589.1682739	0.31
590.2429199	6.27
591.2008667	0.47
592.3414307	0.07
594.8723755	0.06
596.2053833	0.08
600.3878784	0.08
604.2918701	0.33
604.9895630	0.10
608.1784668	56.05
610.0881958	0.45
617.4107666	0.07
623.1571655	0.06
634.1400146	0.10
635.0211792	0.06
636.2090454	0.91
637.7252808	0.35
640.0740967	0.07
641.0177612	3.33
645.4822388	0.24
646.2568970	0.42
649.9501343	0.35
664.0956421	17.60
664.7595825	0.18
665.5657959	0.11
673.6240234	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	565.12
Annotation	Herbacetin 8,4'-dixyloside
Peak:m/z	Relative Intensity
162.9438019	0.03
178.8843689	0.07
221.2454681	0.03
222.8486328	0.14
228.3485565	0.08
234.1629639	0.11
239.1342773	0.02
263.8909302	0.02
275.1601562	0.34
276.9660034	0.01
291.2204590	0.06
304.8688660	0.05
306.2786865	0.06
308.1375732	0.07
315.0786743	0.09
317.1444092	0.03
321.0938110	0.05
322.0592041	0.02
323.3601685	0.05
329.4524536	0.02
333.3823242	0.11
341.6062622	0.07
344.0668945	0.06
349.1110840	0.01
359.2105713	0.11
362.0557251	0.06
379.4548950	0.10
382.4301147	0.21
384.1674194	0.07
385.3919067	0.04
386.2600098	0.08
397.4039917	0.04
399.6701660	0.03
402.1929932	0.03
403.2876587	0.03
407.4456787	0.04
418.2987671	0.20
419.2879028	0.01
429.3803711	0.06
432.0930786	0.02
433.6576538	0.05
436.1286621	0.14
440.2238770	0.14
446.1049194	0.08
446.8650513	0.09
455.2119751	0.15
457.4395142	0.06
458.5341187	0.13
462.2531738	0.06
469.0959473	0.06
472.3721924	0.05
473.4210205	0.11
474.4154053	0.07
476.9608765	0.03
479.1621094	0.33
486.5370483	0.06
488.2930908	0.03
491.2241821	1.21
494.9799805	0.16
502.4060059	0.11
503.0864868	0.05
504.3559570	0.08
505.3636475	1.12
506.1450195	0.02
518.2636108	0.30
519.2522583	1.37
521.2081909	100.00
521.8665771	0.18
523.4140625	0.08
524.1965942	0.27
525.9886475	0.19
527.3588257	0.01
530.5885010	0.17
534.2931519	0.04
535.4884644	0.01
537.1751709	0.03
541.3453979	0.13
545.2387085	0.10
546.4922485	0.44
547.2180176	0.41
550.2068481	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	261.15
Annotation	Cordiaquinol J
Peak:m/z	Relative Intensity
93.00305176	0.72
107.1471863	0.12
129.0111694	0.17
145.1367035	0.10
153.066452	0.52
159.2387543	0.17
163.7965546	0.13
181.2983093	0.25
184.9884033	0.16
186.9947357	0.32
198.8761139	0.30
201.0913849	0.64
205.1441498	0.18
212.7012482	0.18
215.0360718	1.54
217.1226044	1.40
218.0746307	0.17
219.1184235	0.25
219.8415985	0.08
220.9022827	0.08
224.0599213	0.16
226.973053	0.16
233.0346832	0.35
241.1016388	0.26
243.1485748	100.00
243.9852295	0.67
245.293869	3.27
260.9360657	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	369.15
Annotation	U50488
Peak:m/z	Relative Intensity
108.1336594	0.05
115.1470642	0.04
115.9712524	0.11
116.8080139	0.01
122.0839386	0.02
128.0975952	0.06
128.9199829	0.28
134.2279968	0.54
135.0890656	0.11
136.2118530	0.04
138.0301361	0.06
145.0090332	1.44
147.1612701	0.13
152.9934998	0.15
154.9604797	0.05
158.0231934	0.03
160.9570007	0.03
161.9709778	4.15
164.0680542	0.84
167.1029205	0.07
170.9724121	0.12
174.9897766	0.03
176.6604462	0.13
178.0022125	0.21
180.1695557	0.06
182.1195068	0.13
182.8780518	0.04
184.1286469	0.07
187.9554443	0.20
189.0668488	0.03
198.0418396	0.04
204.8361969	0.09
208.1696167	100.00
213.1457672	0.03
221.4304810	0.15
223.2816772	0.04
226.2214355	0.51
227.1257935	0.15
228.1634521	2.16
230.0549316	0.33
231.9975891	0.67
233.2837524	0.03
237.0129395	0.02
238.1525879	0.17
239.1577454	0.08
240.2142029	0.05
241.3612061	0.02
246.1168213	0.48
248.2913513	0.45
251.1377869	0.03
255.1073914	0.03
261.1890869	0.04
262.4100037	0.11
263.4921265	0.08
269.1050720	0.12
274.0455933	16.88
275.1697083	0.16
277.1091309	0.09
278.8632202	0.06
281.4082336	0.08
283.3419189	0.31
291.3693542	0.05
295.2294922	0.98
299.4220886	0.07
305.1137695	0.17
307.0052490	0.05
308.2346191	0.08
309.2992554	0.18
317.7778320	0.07
320.2950134	0.16
321.1379395	0.03
323.1634521	1.00
324.0830688	0.15
325.1948242	0.30
326.0437622	0.03
327.1237793	2.06
327.9421692	0.07
333.2623596	0.12
335.4096680	0.34
337.2875366	0.04
341.0108337	0.07
347.1703186	0.06
348.3114014	0.13
350.3218079	0.55
351.2265320	3.97
351.9868164	0.25
359.7386169	0.29
360.6549988	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3alpha,5beta,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
105.0037079	0.35
106.8358383	0.15
109.1296082	2.99
110.945343	0.24
117.0940247	0.76
120.9929504	4.83
122.9414673	2.95
126.878006	0.09
128.7926636	0.70
130.8781433	1.38
132.9395752	1.05
135.0072632	3.61
137.0807037	0.25
142.8061218	0.98
146.8588867	0.34
149.1889343	1.60
151.0523682	1.03
157.2410583	1.70
157.9172668	1.28
158.7572937	0.28
160.855545	0.80
164.7106018	0.44
167.1204224	0.40
171.1564026	0.55
172.3711243	0.81
173.1395264	0.92
175.091507	1.01
179.3330994	0.84
183.0302124	0.85
187.0122986	0.39
189.056366	1.44
191.1981506	0.40
197.2082214	0.68
203.1145935	0.26
206.0263367	0.26
206.9720917	0.61
209.1426086	0.22
211.1538696	1.17
215.0914917	0.52
216.2166748	0.41
217.0964355	1.16
219.3074036	0.13
223.2085571	0.39
225.1471252	0.99
227.1743469	0.20
229.1966553	0.15
231.2346802	0.53
235.1799316	0.20
237.3393555	0.61
240.9532166	0.75
243.2080688	1.01
245.256073	2.03
247.1931152	7.46
251.3412781	0.19
252.9853516	0.49
257.2154846	0.52
266.6132812	0.81
267.2894897	0.77
271.1161804	0.08
277.1798401	0.17
280.9997559	0.30
283.2524719	1.32
285.1164246	0.14
288.223053	0.17
295.2790222	1.69
298.6784973	0.51
299.541748	0.60
300.2397766	1.11
303.5478516	0.53
305.1567383	2.71
307.12323	0.24
309.9454346	0.41
311.9957886	0.17
313.4307556	0.16
321.8283386	0.42
323.2438354	100.00
341.5646973	1.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	176.0386
Annotation	Entadamide C
Peak:m/z	Relative Intensity
71.0200806	3.49
71.8963776	2.57
73.8369598	100.00
85.9575500	0.38
88.9271851	61.95
91.8638000	0.15
113.9985657	1.41
117.8795624	0.20
119.9839020	2.22
126.1644135	0.21
132.0554199	0.17
134.8622437	85.40
142.0615692	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	799.2303
Annotation	Malvidin 3-rutinoside-5-glucoside
Peak:m/z	Relative Intensity
271.4054260	0.13
281.0256042	0.34
323.2167053	0.14
381.1632690	0.17
427.2291870	0.36
443.2556763	4.09
451.4128418	0.39
452.1873779	0.13
475.3139038	0.72
485.2453613	0.53
489.0838013	0.44
499.2309570	4.38
507.4037476	0.21
516.2697754	0.15
526.5307617	0.30
529.0460815	0.09
532.5242920	0.14
537.2665405	0.05
549.0625000	0.19
551.1370239	0.42
570.7965698	0.11
575.3463745	0.16
593.4335327	0.10
601.4453125	0.06
605.5008545	0.31
607.0529175	0.26
613.2604370	0.22
623.4014282	0.33
625.3159790	0.34
631.3850708	1.66
632.1508179	0.12
637.2390137	100.00
637.8422852	0.38
638.5668945	0.08
648.6103516	0.08
649.9787598	0.05
652.6181030	0.17
664.5772095	0.08
665.7866821	0.13
679.3173218	1.31
696.4127808	0.14
701.1427612	0.09
703.1265259	0.16
707.2070923	0.25
711.2600708	0.08
733.5720215	1.16
736.5946655	0.35
740.4310913	0.10
741.5234985	0.29
754.6101685	0.14
755.2173462	0.43
769.1914062	0.12
780.5004272	1.98
781.3621216	0.36
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	563.18
Annotation	Unknow
Peak:m/z	Relative Intensity
161.9833069	1.49
199.2305298	0.19
210.9539490	0.12
219.3096771	0.21
223.1132050	1.00
228.1649170	0.37
240.9966583	2.96
273.0993347	0.50
284.9612427	0.12
286.4375610	0.31
289.0092773	0.17
290.0790405	0.36
291.1707764	0.28
295.1312866	0.07
300.0152588	0.14
309.4233398	0.19
310.1188965	2.99
313.2919312	1.24
317.0695801	0.07
328.0304565	0.42
334.1771851	0.17
338.1234131	1.78
341.9412231	0.99
344.3513794	0.34
345.1809692	0.15
349.3128052	0.08
353.0833740	0.11
356.1427612	3.02
357.2692871	0.31
358.0712891	0.14
360.2208862	6.29
361.1301880	0.40
363.2037964	0.21
366.0682373	5.51
367.0654297	0.52
371.0213013	0.72
376.2555542	0.15
384.1459961	9.27
386.2051392	0.68
402.1428833	54.35
415.2369385	0.27
429.9463501	0.17
431.4628296	0.07
434.2120972	0.59
445.2014160	0.05
446.9707031	0.44
450.5853271	0.25
453.2893677	0.51
456.5675659	0.11
473.3831177	0.50
478.1094360	0.06
481.8250732	0.87
487.4920044	0.04
489.3590088	0.16
499.5329590	0.26
503.1774292	0.11
509.3065186	0.32
517.0669556	0.21
518.3274536	0.13
519.4874268	0.11
521.0510254	0.16
522.2097778	0.21
525.9691772	0.14
527.3015747	1.04
529.7327881	0.18
537.6607056	0.25
545.2659302	100.00
546.2448120	2.59
547.2080688	0.84
562.8277588	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	351.1541
Annotation	PA(6:0/6:0)
Peak:m/z	Relative Intensity
100.8224411	0.05
102.9995422	0.60
114.0350342	0.72
115.0564804	0.05
120.0278931	15.48
130.0027771	4.78
131.9481812	2.30
140.1349792	0.18
141.8821716	3.89
149.1142273	0.21
151.8781738	0.14
156.2956085	0.05
166.0276489	43.52
166.7839661	0.06
167.8756866	0.17
178.0636597	25.63
186.0167847	55.76
204.0751038	5.31
215.4520874	0.22
217.0205688	0.10
218.8653870	0.09
222.2768860	0.18
224.0744019	0.10
224.9858093	0.13
229.1750488	0.17
236.0811157	0.14
245.1474304	0.03
249.0247192	0.08
254.2740784	0.12
257.4005127	0.05
261.1397095	0.21
263.0269470	0.05
264.2263794	0.12
265.3191223	0.12
272.8305664	0.08
274.1759033	0.14
278.0697327	0.88
287.1539307	0.80
288.8346558	0.12
289.5376587	0.37
293.3614807	0.29
295.1441040	4.52
302.5914307	0.28
305.0982056	0.47
307.0726929	100.00
310.5388184	0.07
313.2845154	0.23
314.0935974	0.36
315.2388916	0.34
320.5362244	0.11
322.2792358	0.21
323.2287903	0.02
327.7984009	0.08
333.1223145	17.27
333.9270935	0.02
337.5930176	0.15
340.6009521	0.53
341.7113953	0.36
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	302.15
Annotation	Febrifugine
Peak:m/z	Relative Intensity
95.0621719	0.27
109.7698059	0.16
116.0391159	0.07
120.8375092	0.07
123.0751419	0.03
128.8358765	0.15
133.7510376	0.13
136.0604553	0.12
137.0437622	0.03
138.8462219	0.11
140.1287842	0.26
142.1225433	0.05
146.9509888	0.04
148.0756683	0.35
150.2307281	0.09
151.9463806	0.04
153.1242981	0.07
156.0997314	1.40
157.4998779	0.07
158.1429291	0.14
159.0665436	0.24
160.0524445	0.67
161.0404358	0.23
162.9079895	0.63
170.9916229	0.22
180.1680298	0.46
182.0114136	0.10
187.1014404	0.07
187.9594421	0.05
193.8595581	0.25
195.1239777	0.38
196.1241150	0.24
196.9351196	0.06
202.1438599	0.68
203.0180664	0.09
204.2038269	0.27
205.1239319	1.34
206.6824951	0.07
210.4246826	0.16
212.1401978	0.80
213.0441284	0.23
214.2410583	0.19
215.9975891	0.10
220.2247925	0.07
222.0834351	0.24
223.1005859	0.13
224.0431213	0.13
227.2539368	0.09
228.0922546	0.82
229.3406067	0.38
230.2238159	6.80
231.8418274	0.18
235.2226257	0.11
237.0279846	0.04
238.1749878	0.32
240.1508179	100.00
241.5953979	0.08
242.9996338	0.11
243.8129272	0.16
245.2882080	0.37
246.1890564	0.13
250.3567200	0.08
253.1443481	0.30
256.2377930	3.19
257.1289673	0.97
258.2610168	19.55
259.5848083	0.28
260.9165955	1.90
261.8612366	0.19
262.7576294	0.16
264.3505249	0.13
264.9661255	0.42
266.1936035	0.21
267.2363281	0.14
268.2716675	1.00
270.8507080	0.48
274.1926270	3.02
278.8968506	0.48
280.2238464	0.21
281.1233521	0.55
284.1712341	17.19
285.2659607	0.17
292.6452026	0.46
293.4580994	1.64
294.4276428	0.24
295.1456299	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	723.9991
Annotation	Unknow
Peak:m/z	Relative Intensity
240.1277924	0.17
309.3455200	0.10
328.1718140	0.10
372.1138306	1.84
391.3543091	0.29
426.8853760	0.47
444.2688599	0.13
457.5018311	0.26
500.7886963	0.15
511.8071899	0.16
516.0560303	0.47
547.9642944	100.00
548.6528931	3.36
560.0633545	0.06
564.4491577	0.84
565.8822632	0.33
583.1668091	0.18
588.7001343	0.94
590.8676147	0.18
594.3587646	0.12
598.3779297	0.17
612.3677979	0.19
634.0864868	0.92
638.9600220	0.07
653.6213989	0.69
661.4646606	0.52
670.8123169	0.16
677.8772583	0.54
678.9666138	0.09
688.0140991	0.31
705.5499878	1.33
706.3607788	0.74
742.9152222	0.53
804.1446533	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	363.1539
Annotation	4,6,7-Trihydroxy-1,2,3,4-tetrahydroisoquinoline
Peak:m/z	Relative Intensity
123.1014252	0.11
128.9862823	0.08
135.9930115	2.09
136.9184723	0.13
146.8840332	0.33
165.0551453	6.31
178.2926636	0.17
181.9867249	100.00
188.9731293	0.21
200.1219940	0.33
201.0026398	0.38
205.9020996	0.08
214.7130737	0.06
249.2522278	0.13
259.2278442	0.28
261.9727783	0.12
271.0596924	0.14
272.1019897	0.22
273.1079407	1.96
283.9751587	0.38
298.2796631	0.19
299.0538940	0.38
301.3285522	0.05
302.3342896	0.04
305.1262207	0.16
314.9691162	0.33
316.1398926	4.12
317.2286377	2.17
319.2585449	0.13
344.9368896	0.93
346.3013611	0.64
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	567.13
Annotation	Herbacetin 8,4'-dixyloside
Peak:m/z	Relative Intensity
162.0835724	0.22
181.1593475	0.02
185.0837708	0.08
186.8654480	0.04
195.0470581	0.30
197.8465118	0.09
216.8889618	0.08
227.8565369	0.12
231.1761932	0.89
240.7261047	0.01
243.1160278	0.12
258.9896851	0.25
268.9515076	0.05
273.1127930	0.41
274.2266235	0.03
277.1221924	6.68
287.3847046	0.05
291.1832886	5.65
292.9484253	0.09
295.1477661	0.38
301.1688232	0.36
312.8934326	0.03
317.1860962	0.11
318.1338501	0.19
319.1624756	2.24
322.8102417	0.10
325.2144775	0.08
332.1805420	0.08
333.1618652	0.10
342.8580322	0.08
346.2670288	0.21
350.2980347	0.15
352.3121948	0.14
353.0101318	0.02
355.1412354	0.05
357.3842163	0.05
360.1946411	0.11
361.1992798	1.07
362.1604004	0.35
364.0105591	0.14
365.1735229	0.02
370.8555908	0.04
372.7454834	0.09
383.0358276	0.04
386.1598511	0.12
387.9946899	0.25
390.2752075	0.12
392.2493286	0.36
393.2171021	0.03
401.1170654	3.61
402.0422363	0.22
403.2495117	0.20
405.2280273	0.30
406.2612915	0.38
409.4761963	0.04
411.9688721	0.09
419.0722656	0.11
420.1383667	0.69
424.1813354	0.02
427.0333862	0.03
427.6624146	0.10
432.3838501	0.25
433.2126465	0.20
435.2700806	0.07
436.3412476	0.59
438.1654663	100.00
438.8431396	0.16
440.1938477	0.16
441.4224243	0.06
444.1080933	0.03
445.4382324	0.19
446.1249390	0.08
447.4418335	0.02
456.1078491	0.06
457.0064087	0.09
458.9376831	0.06
460.3319702	0.05
475.4075928	0.06
476.2847290	0.31
477.3031006	0.36
481.3584595	0.03
486.1627197	0.17
490.1915283	0.02
491.1085205	0.03
492.1550293	0.18
501.4401245	0.05
503.6488037	0.26
504.4141846	0.40
512.2621460	0.18
521.5276489	0.08
522.7120361	0.42
525.0798340	0.10
531.1812744	1.70
532.8327637	0.10
539.7662354	0.31
544.9700317	0.42
549.1782837	12.63
550.2689819	0.10
552.9451904	0.20
560.7859497	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	175.1186
Annotation	L-Arginine
Peak:m/z	Relative Intensity
59.8936195	37.80
69.9095917	5.15
72.0470123	1.29
96.7812500	0.77
98.3332062	0.49
112.0379486	4.75
112.8864594	0.12
114.0494843	3.64
115.3196411	3.04
116.0067596	51.51
116.7920685	0.10
130.0213928	33.44
131.2628937	0.10
139.9629974	3.13
141.2277985	0.12
156.9983978	85.29
158.0689240	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	684.13
Annotation	Unknow
Peak:m/z	Relative Intensity
196.9214172	0.21
199.1461334	0.07
202.3493195	0.02
226.0522461	0.22
228.2626953	0.06
230.9762726	0.06
232.1506653	0.15
232.8679199	0.05
239.0895691	0.11
244.0401306	0.05
252.3865356	0.07
253.4052429	0.19
254.1923523	0.90
255.3783875	0.07
270.2238770	0.05
272.2220154	0.16
273.1647339	0.12
278.9586792	0.04
279.8429565	0.32
287.2436829	0.17
288.3167725	0.92
289.2592773	0.60
290.3171387	0.26
297.3925171	0.11
302.1461182	0.13
304.3618469	0.06
306.3340454	0.08
315.1903076	0.13
321.3085327	0.42
323.2515869	0.70
324.3474731	0.32
326.0278320	0.47
326.7492676	0.21
328.3170166	0.05
339.2081909	0.19
341.0045471	1.35
342.2088623	0.81
351.2415771	0.07
353.2805786	0.21
355.0743408	0.22
355.9635010	0.08
357.2603760	0.19
360.0670166	0.54
361.2252197	0.40
362.2578125	0.49
365.1979980	0.29
373.2377319	0.23
373.9381104	0.15
375.4246216	0.37
376.3215332	0.25
377.0272217	0.16
378.2222290	0.32
379.2282104	0.51
380.3114014	0.74
383.0937500	0.66
384.2089233	0.32
387.1761475	0.17
388.0573120	0.24
390.3655396	0.03
391.1672363	0.09
392.1499023	0.07
395.3431396	0.24
395.9761963	0.11
400.1666260	0.10
403.3303223	0.33
406.1995850	0.70
407.1959839	1.06
408.3435669	0.30
409.3148804	0.12
410.4187012	0.07
411.1354980	0.07
412.3939209	0.20
413.0598755	0.12
415.3312378	0.03
416.2426758	0.07
417.2832642	0.79
418.1815796	0.03
419.3031616	0.18
425.2420654	0.10
426.4054565	0.94
427.4149170	0.13
429.1568604	0.87
430.2905884	0.38
431.5448608	0.08
432.3220825	0.05
433.9743042	0.57
435.3488159	0.21
441.0802612	0.14
447.2675781	5.41
448.1531982	6.63
449.2708130	2.94
450.2175903	0.26
451.1716309	1.24
452.2493286	2.37
453.2329102	1.15
454.4545288	0.07
458.3182983	0.39
459.2919312	0.15
460.5081787	0.37
462.3885498	0.09
466.3510132	0.07
469.1793823	0.14
470.2155151	4.14
471.2907104	4.35
472.2857666	1.98
473.3143921	0.18
474.2399292	0.15
475.2106934	0.17
480.5690308	1.30
481.2947388	0.20
484.2788696	0.72
485.3371582	0.33
486.1209106	0.42
487.7417603	0.91
489.0592651	1.69
490.3195801	3.19
491.2832031	1.84
492.1331787	0.09
493.2890625	1.17
496.3463135	0.42
501.0871582	0.82
502.3245239	0.67
503.3729858	0.91
504.2640381	0.92
505.3063965	1.05
512.2142334	0.23
513.3317261	0.17
514.0602417	0.39
515.2754517	0.48
516.2557983	0.28
517.2180786	1.06
518.2412720	1.81
519.3085938	1.39
520.2416382	0.35
523.4194946	0.08
524.2769775	0.44
525.3916626	0.09
526.4609985	0.11
530.2576294	0.25
531.3518677	0.18
532.5115356	0.82
533.2922974	1.59
534.2592163	1.80
535.0526733	2.88
536.2425537	15.69
537.2072144	21.13
538.2847290	11.15
540.2941284	0.49
541.1550293	1.53
542.2562866	0.87
543.1346436	0.23
544.0392456	0.94
545.3015747	0.43
546.2857056	0.21
547.3875122	0.20
550.4464722	0.08
551.3352661	0.25
552.2251587	0.18
553.3331909	1.48
554.2321167	3.71
555.2528687	3.16
558.1891479	12.98
559.2138062	25.28
560.2542114	10.38
561.1696167	0.04
564.1526489	0.25
565.3603516	0.05
567.0864868	0.89
568.1339722	7.54
569.1539917	18.03
570.2088623	16.24
571.3332520	0.73
576.2285156	47.19
577.1855469	100.00
578.2081909	45.04
579.2456665	0.12
581.2710571	0.24
582.4430542	0.29
590.2378540	0.27
591.0984497	1.66
592.2422485	0.73
593.1730347	1.35
594.3325195	0.60
596.9074097	0.07
598.0888672	0.13
599.2882690	0.33
600.6008911	0.13
602.1509399	1.99
606.0330811	0.32
606.9663696	0.66
608.2971802	3.20
609.2129517	10.97
610.2119751	9.11
611.1837158	9.71
612.2045898	5.51
621.6559448	0.05
624.0407104	4.87
625.2166138	4.35
626.0737305	0.25
638.9049072	0.26
639.6314697	0.25
641.1715698	8.46
642.1546631	72.28
643.1486816	49.57
643.7545776	0.15
647.1467896	0.91
648.4002075	0.04
665.1510620	31.66
666.2463989	18.65
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3alpha,5beta,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
106.9416428	0.64
109.0538788	2.38
111.1264725	0.14
113.1231995	0.49
115.0337296	0.15
117.0293961	0.42
119.0508728	0.17
120.9133377	2.87
123.0927124	0.73
126.8403931	0.43
128.8249207	0.44
130.9593506	0.32
133.0653687	0.57
135.0747528	2.23
136.9937744	1.01
140.8953247	0.69
142.9607544	1.38
144.8720703	0.18
146.9382629	0.63
149.0774536	2.17
151.0403595	0.88
152.8246613	0.44
154.9265137	0.96
157.0072327	0.76
158.9476929	0.98
161.0518036	1.02
163.1048889	1.40
165.1918335	0.28
169.115448	2.05
171.187561	0.20
173.001709	0.65
175.0075073	1.25
177.1867676	0.52
178.2230225	0.18
179.1079559	0.31
180.0407867	0.13
181.1803589	0.08
182.8764038	0.91
183.6179962	0.28
187.1947632	0.95
188.8998718	0.42
193.0892181	0.14
194.8862152	0.21
199.2230835	0.23
201.1658173	0.07
203.1090393	0.98
205.1257629	0.31
207.0122375	0.17
208.9721375	0.39
211.1257629	0.88
213.2852478	0.52
217.0700378	0.95
221.0161743	0.35
223.407196	1.23
225.0292358	0.51
228.1627197	0.18
229.2004089	1.30
231.2790527	0.52
233.3421326	0.17
233.996582	0.54
234.8822021	0.10
241.2454224	0.18
245.1426392	1.44
247.2168884	3.86
251.2865601	0.73
252.9155884	0.11
255.045105	0.60
257.3310242	0.25
259.1266174	1.17
265.5130005	0.18
266.9179077	1.32
269.5013428	0.10
272.9328918	0.16
278.9137268	0.72
281.315979	0.34
284.2589722	0.22
287.6847839	0.46
288.4785156	0.31
289.2008667	0.18
297.2599182	0.55
299.3070679	0.77
300.2814026	0.55
305.2820435	2.70
307.3908386	0.74
309.5968933	0.18
313.289917	0.07
323.2445679	100.00
324.2912292	0.92
325.2616882	0.52
341.0281677	2.51
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	470.1072
Annotation	Tuberosinone N-beta-D-glucoside
Peak:m/z	Relative Intensity
145.0117493	6.82
147.9871368	0.55
150.0722656	0.28
157.2937317	0.11
161.8497162	0.74
164.3006287	0.08
169.9947205	0.28
176.2976685	0.44
176.9981384	1.02
189.1389771	0.15
199.1106262	0.56
202.0251465	0.71
203.2263031	0.04
204.2098389	0.05
208.9146423	1.91
210.9980774	1.49
217.0855560	0.56
224.1078033	0.04
231.2611389	0.12
233.0025177	0.08
235.2992706	0.15
238.6147156	0.39
248.9398193	0.13
249.8062744	0.12
251.0841675	51.53
255.3497314	0.19
255.9971619	0.07
258.3864746	0.22
261.0430908	0.17
265.0500488	0.11
267.0692749	0.08
274.0814514	33.61
274.8296814	0.38
276.2098389	0.60
277.1611938	0.16
279.0620422	0.16
283.0430908	1.57
284.2599487	0.21
286.1821899	0.07
289.5022888	0.13
291.1929321	0.27
292.1877747	0.11
293.1210327	0.20
294.5659485	0.07
297.3456421	0.36
302.1596680	0.78
303.0527954	0.06
305.2090454	1.80
306.0317993	0.93
307.2218018	0.14
308.2586060	0.18
311.1534424	0.65
312.3507080	0.41
314.3186951	0.42
318.1773071	0.15
319.2525635	0.08
320.2987671	0.80
321.5186768	0.53
323.3431396	1.10
324.2130737	1.88
324.9130859	0.15
330.5829468	0.15
332.1079712	0.09
335.3919067	0.09
341.0417786	70.71
347.8587646	0.09
348.4946594	0.20
349.2277222	0.38
352.2246399	0.64
353.3625488	0.54
355.3679199	0.12
357.3761597	0.05
360.6707153	0.20
362.0581360	1.69
364.2945557	0.34
377.9834900	0.05
380.0921936	100.00
380.7582397	0.10
390.1356506	0.12
395.0330505	4.80
396.1839905	0.96
401.7179871	0.08
405.9315491	0.23
407.1031799	0.10
408.5032043	0.15
411.9505310	15.35
412.7028198	0.18
414.3043518	0.18
422.0598755	1.43
424.3261414	0.66
425.2862244	0.05
426.4222717	0.50
429.1598816	4.11
433.2344971	0.18
434.4363403	0.59
437.3420410	0.09
443.6805725	0.17
447.4197083	0.88
451.5039978	6.11
452.2987366	3.11
460.7557983	0.20
461.7025452	0.60
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	705.1823
Annotation	Lychnose
Peak:m/z	Relative Intensity
363.1676636	4.16
364.0137939	0.10
381.1562500	6.83
453.5435181	0.04
525.2888794	13.09
526.4422607	0.13
543.2223511	100.00
543.8466187	0.31
615.3009033	0.06
645.2858887	0.03
687.1940308	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1151.3752
Annotation	Unknow
Peak:m/z	Relative Intensity
322.9886169	1.28
341.1041260	0.86
359.2578125	0.25
375.1358032	0.34
383.2527466	16.96
412.8789673	0.38
443.2945557	0.36
449.2128906	0.38
467.4513245	0.61
485.2933350	8.74
503.1390381	7.88
527.4531860	0.12
543.2330933	0.84
545.3206177	7.99
557.2342529	1.95
569.4215088	0.14
573.2821045	0.60
575.4892578	0.49
611.1682739	0.69
629.2420654	0.29
641.2515869	0.48
647.2392578	32.04
649.2136230	0.83
665.3431396	28.30
689.3240356	0.70
705.4569702	0.18
707.3312988	38.86
708.3474121	0.10
713.6301270	1.04
719.3705444	0.93
731.2520752	1.71
735.1042480	0.21
737.5287476	0.12
739.3544312	0.68
791.6245117	0.48
803.4654541	0.20
809.3426514	26.83
826.7585449	1.67
827.3742676	37.08
869.3342285	40.25
880.6353760	1.16
881.3773193	0.31
899.0854492	0.40
901.6206055	0.15
953.5344238	0.79
971.3836670	23.49
989.3178711	100.00
989.9183350	0.22
1043.6663820	0.88
1059.4498290	1.01
1061.7897950	5.02
1062.6694340	2.25
1133.3985600	3.81
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	441.2
Annotation	Unknow
Peak:m/z	Relative Intensity
130.0362396	0.14
144.9578247	0.10
146.0514832	0.45
146.9588318	0.18
148.1724091	0.22
162.0854187	13.41
164.1815948	0.05
169.9819183	0.11
178.2503052	0.22
203.1962280	0.38
205.1329956	0.76
206.2226257	0.46
207.1918182	0.19
221.1820984	4.20
223.1573944	4.63
231.4127808	0.25
236.0171661	0.04
247.2217102	0.04
248.1780701	0.18
249.5217590	0.04
263.2766113	0.04
265.1095886	100.00
265.7452087	0.32
267.2077942	3.88
273.9424744	0.11
275.0872803	0.10
276.6961365	0.36
277.3924561	0.08
279.1045227	0.13
284.3441162	0.08
285.0238647	0.08
292.0659180	0.05
293.0197449	0.10
302.1731567	0.09
305.2959290	0.10
307.1645813	0.16
309.1314697	0.25
314.2465515	0.04
319.3292847	0.20
324.4026489	0.04
335.1777649	0.32
343.2233276	0.05
348.4119263	0.04
349.1661987	0.08
351.1147461	0.57
361.2714844	0.19
363.1990356	0.04
367.9660645	0.12
375.5199890	0.46
376.1518860	0.36
377.0903015	0.12
380.9664917	0.29
388.2340698	0.05
389.8802490	0.23
394.7913513	0.43
396.4313965	0.22
397.5333557	0.26
398.1536255	0.11
405.2810974	0.18
408.9320679	0.04
413.4471130	0.26
418.5222778	0.41
420.5317383	0.24
422.3854675	0.26
423.2947693	2.13
432.3663330	0.89
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	165.02
Annotation	Unknow
Peak:m/z	Relative Intensity
56.8767052	0.16
58.9188881	0.74
72.8313141	8.48
74.7452469	9.62
75.3498917	0.04
80.9731750	0.14
86.9572296	2.12
88.8162689	4.90
90.8437271	8.59
92.8989563	8.44
93.5437775	0.11
94.8504181	2.28
96.8986969	0.06
99.0612183	0.12
103.0176239	0.14
103.9637604	0.07
104.8954773	2.17
106.9152832	1.12
108.2629395	0.19
108.9376068	1.96
112.8382874	0.40
114.9866333	0.52
118.3354187	0.05
119.1232605	0.26
120.9081421	0.84
121.7601166	2.37
122.8446503	100.00
123.5865631	0.39
137.0246124	0.12
146.9188995	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	316.2839
Annotation	Halisphingosine A
Peak:m/z	Relative Intensity
93.00416565	0.08
94.95339966	0.92
96.92533112	0.24
99.04476166	0.34
101.9305267	0.11
105.0623322	0.32
107.0977173	0.65
108.1638641	0.28
108.972702	1.39
110.1785126	0.18
110.9920273	0.40
111.843544	0.22
112.5777588	0.06
115.0480042	0.21
116.1836472	0.11
118.8002625	0.93
121.0095367	0.95
123.1425858	1.39
133.0736694	0.78
133.8614197	0.05
135.0957794	1.26
136.9825592	2.08
139.133606	0.21
140.1697693	0.26
145.1654358	0.09
147.1697388	0.51
149.1168213	0.54
151.1332092	0.48
154.0240479	0.39
154.9927063	0.82
157.9816589	0.24
161.1466217	0.85
162.105957	0.10
163.3128052	0.62
164.9293518	0.27
167.0697937	0.27
169.2497711	0.33
171.5189819	0.04
175.2089386	0.68
176.7184296	0.34
179.0986938	0.19
182.1123962	0.08
183.2110901	0.14
184.0916901	0.05
185.0626831	0.06
186.2506409	0.13
189.3535156	0.10
190.9760437	0.09
191.8388672	0.13
192.9973297	0.04
193.8126831	0.05
196.2309113	0.31
198.6738892	0.50
205.3435974	0.70
206.9953613	0.36
209.0452271	0.28
210.9425049	0.32
214.0576782	0.15
217.2445679	0.14
219.0484009	1.05
220.8235168	1.21
221.4573669	0.65
223.9875183	0.11
225.1928711	0.22
226.190918	0.46
227.1433716	0.11
228.3087463	0.11
229.1856689	0.21
231.2588501	0.06
233.1853027	2.06
235.4355164	0.14
237.1817932	0.50
239.0041199	1.62
241.2548218	0.04
242.2255249	1.23
245.1333313	2.47
250.2880249	1.00
251.2564087	2.36
252.3504944	0.89
253.149353	0.07
254.4428711	0.23
257.289032	0.06
260.2874146	0.14
262.3516235	4.25
263.313324	3.46
266.7073975	0.40
268.3793335	0.99
269.1071167	0.05
270.1568604	0.35
271.066803	0.13
272.1480713	2.28
274.2844238	0.22
275.7483215	0.51
280.3325806	63.56
281.2895813	0.94
285.0229492	0.21
286.1525879	0.09
298.2793884	100.00
299.1560364	3.26
301.1850281	0.06
316.475708	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	310.1117
Annotation	Unknow
Peak:m/z	Relative Intensity
88.9018555	2.35
93.9353256	1.34
97.0129471	0.06
100.0092773	0.88
100.8495483	0.84
114.8578491	0.09
125.6590576	0.27
131.1326904	0.07
136.9951935	0.07
145.9971771	0.16
149.9924316	0.09
152.8459167	0.12
174.2048035	17.12
176.0565033	41.83
178.6031189	0.14
206.7745667	0.06
208.0782471	100.00
220.1306152	15.67
228.1689453	0.12
235.3739014	0.14
237.5021362	0.05
238.3525696	0.32
239.5439148	0.11
247.1448669	0.11
248.1217651	0.87
249.6607361	0.05
252.2339478	0.78
254.0899658	0.29
260.3142395	0.17
263.9863892	1.36
265.1966553	0.61
266.1879883	1.06
269.1255188	23.98
274.0146484	0.21
275.2041016	0.05
291.2428589	0.59
292.2516479	0.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	682.1348
Annotation	Unknow
Peak:m/z	Relative Intensity
190.0707092	0.04
197.0207520	0.50
198.3750305	0.01
213.1622009	0.05
225.9978790	0.03
229.1857910	0.06
236.1399841	0.05
237.0640717	0.02
238.1369629	0.06
243.1921692	0.03
243.9887695	0.05
250.1188354	0.09
252.0859680	0.11
253.0834503	0.06
254.1495667	0.70
260.2157593	0.04
264.2576599	0.06
272.1635132	0.24
273.2890625	0.16
277.3479004	0.12
279.3233643	0.06
280.3798828	0.02
286.1987610	0.08
287.1350708	0.11
288.1063232	0.41
289.4125977	0.15
295.2288818	0.15
296.4188538	0.05
297.3836670	0.09
298.0407104	0.05
300.8676758	0.03
303.0963745	0.19
306.3179321	0.11
308.2242432	0.04
311.2111816	0.02
312.2656860	0.05
315.0249329	0.03
316.3529053	0.15
318.9677734	0.03
320.0130615	0.03
320.9924316	0.06
322.1642456	0.03
323.1732483	0.57
324.3047485	0.13
325.9892273	0.32
328.4125366	0.09
329.3061829	0.03
337.0953674	0.07
339.2980957	0.04
341.2613525	0.64
342.1962891	0.08
346.1574097	0.04
355.1884155	0.71
356.3091431	0.12
358.2841797	0.15
360.1013794	0.79
360.9486694	0.06
362.3651733	0.15
363.2566528	0.11
364.1555786	0.03
365.3075562	0.09
370.9323120	0.08
373.0799561	0.60
374.1588135	0.17
375.2425537	0.18
376.1908569	0.16
378.2262573	0.75
379.1449585	0.23
381.0328369	0.01
383.2317505	1.09
384.4556885	0.20
386.9837036	0.11
389.2824707	0.15
390.2352905	0.42
391.0599976	0.04
395.3454590	0.03
396.3948364	0.05
405.2605591	0.30
406.3391724	0.79
407.4859619	0.61
409.0493774	0.47
410.0431519	0.13
412.4612427	0.05
415.1127930	0.16
416.2022095	0.07
417.4311523	0.02
418.4024658	0.03
420.2803955	0.07
421.1929321	0.23
424.4669189	0.31
426.1883545	0.42
427.0877075	0.26
428.0574951	0.04
429.2930908	0.33
430.5181885	0.06
431.1862183	0.04
432.2544556	0.20
433.2667236	0.04
434.2788696	0.28
435.1657104	0.07
437.2132568	0.10
438.4332275	0.06
439.3237915	0.07
440.5348511	0.28
441.2514038	0.09
442.2044067	0.12
446.0847168	0.27
447.1847534	7.30
448.3097534	1.44
450.0945435	0.71
450.9429321	0.10
452.2611694	3.16
453.1499634	0.40
456.3334351	0.27
458.1960449	0.82
459.2749023	0.31
460.1484985	0.03
461.1938477	0.14
462.0894775	0.21
464.6103516	0.06
466.3527832	0.13
470.1878052	4.28
471.2702637	1.45
472.2743530	0.02
473.4549561	0.10
474.2880249	0.18
475.2510376	0.10
479.1629028	1.29
480.2555542	0.71
480.9368286	0.03
482.4707642	0.04
484.2631836	1.51
485.3559570	0.50
486.3696289	0.12
487.2864990	0.11
488.1597900	0.70
489.2283325	2.65
490.3203735	0.93
491.3303833	0.11
492.3605347	0.07
493.3850708	0.02
496.3491821	0.06
498.4722900	0.14
500.2506714	0.13
501.3203735	0.32
502.2753906	2.72
503.1954346	0.99
504.1946411	0.56
505.3745117	0.24
506.1093140	0.03
512.0604248	0.30
514.2313843	0.90
515.3706665	0.51
516.2794189	0.40
517.3404541	0.66
518.0622559	0.46
520.8039551	0.14
521.4545288	0.12
523.2515259	0.37
524.1533203	0.21
525.1405640	0.21
532.2539673	1.43
533.2745361	0.60
534.1959839	2.00
535.2191162	3.13
536.2467651	7.89
537.2907104	1.85
540.2634888	1.05
541.2687378	0.71
544.3707886	0.03
547.1204224	0.15
549.2853394	0.22
550.0540771	0.40
551.1926880	0.38
553.1268921	4.26
554.1735840	0.78
556.2198486	0.06
558.2111206	25.20
559.2444458	7.77
559.9937134	0.12
564.1857300	0.49
568.1529541	41.35
569.2402954	14.32
572.0994873	0.24
574.0858765	0.14
576.2194824	100.00
577.2329712	27.48
578.0710449	0.20
579.3690796	0.09
588.9779663	0.04
590.1788940	3.44
591.3283081	0.70
592.2166138	0.35
593.0618286	0.24
604.1652832	0.03
605.4339600	0.07
608.1680908	25.27
609.1721191	7.28
610.2476196	3.52
611.2381592	0.79
623.1231079	2.41
624.1494141	1.60
624.8426514	0.01
641.1297607	16.07
642.2174683	4.86
644.4274292	0.17
646.1873779	0.33
647.0756226	0.03
664.1362915	24.94
665.1441040	9.28
666.1840820	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1243.5984
Annotation	(3b,5a,6b,22a,25R)-Furostane-22-methoxy-3,6,26-triol 3-[glucosyl-(1->2)-[xylosyl-(1->3)]-glucosyl-(1->4)-galactoside] 26-glucoside
Peak:m/z	Relative Intensity
433.4067383	0.16
434.3897705	0.11
453.1888123	0.06
503.5855713	0.11
575.8309326	0.06
595.4779053	0.64
596.5750732	0.33
704.6370239	0.03
739.4646606	0.16
740.5035400	0.25
757.5007935	19.53
758.4999390	9.74
759.2241211	0.10
774.5072021	0.03
790.4613037	0.04
836.8601074	0.02
837.6187744	0.02
838.7281494	0.03
853.8253174	0.39
854.6995850	0.46
865.5675049	0.67
866.4699707	0.45
872.5523682	0.05
901.5330811	0.96
902.5949707	0.41
919.5662842	17.28
920.5467529	8.38
921.1697998	0.01
976.4468994	0.08
1015.7207030	0.06
1045.4190670	0.01
1063.4617920	0.62
1064.2929690	0.05
1081.5534670	100.00
1082.5625000	56.55
1083.3530270	0.03
1097.2207030	0.30
1190.9121090	0.03
1225.8085940	0.02
1226.5622560	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	392.1131
Annotation	(gamma-Glutamyl-gamma-glutamyl)-S-methylcysteine
Peak:m/z	Relative Intensity
119.0708237	0.12
126.1019897	0.14
127.9817352	2.60
135.2243652	0.42
143.0752563	4.62
145.0582275	0.27
146.2019348	0.16
160.1356506	0.50
167.1584167	0.19
171.2421265	0.48
177.0936890	0.14
179.0273438	9.04
181.9049225	0.08
185.1243591	0.46
192.1743927	0.06
197.1139832	0.93
210.0901489	4.27
213.2118530	0.12
228.0015564	0.18
230.8262024	0.06
236.2752380	0.36
242.0480347	0.08
245.1158447	0.11
254.1759033	72.39
263.2079163	4.87
272.1192627	100.00
272.9306946	0.09
288.1269226	4.44
306.1672668	48.22
328.5548401	0.11
374.1704407	18.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	496.0875
Annotation	Unknow
Peak:m/z	Relative Intensity
154.0640717	0.09
156.0561371	0.29
157.1984558	0.02
158.9117737	1.20
166.1180115	0.10
169.2154083	0.03
170.9847717	0.17
172.1718445	0.10
185.0668640	6.58
186.1130066	17.08
188.1287537	0.10
195.3386841	0.05
200.9509888	0.10
206.1299744	0.06
212.2581177	0.08
214.1232758	0.04
215.1347046	0.05
216.0573578	0.12
217.2165985	1.32
218.0243530	0.24
221.1576538	0.09
223.2428589	0.07
224.2098389	0.04
225.0202789	0.25
226.6721649	0.09
229.0510559	0.41
230.1647339	2.37
235.2884216	0.09
236.9610596	0.18
239.8478851	0.07
252.1728210	0.10
253.1959229	0.02
256.9895325	0.07
261.9285278	0.04
263.0458069	0.11
265.8898621	0.05
266.8594055	0.19
268.3300476	0.03
269.0114441	0.35
270.3043518	0.17
271.0417480	0.07
274.9280396	0.12
275.9923096	0.04
280.0023804	0.09
281.2216797	0.32
282.2409973	1.55
287.0280762	0.77
294.0244141	0.17
296.2075195	8.40
299.1962280	0.10
303.2138672	0.07
308.0938721	0.20
309.1701965	0.03
311.1862793	0.15
312.0818481	0.22
314.2271729	1.44
319.2188721	0.12
322.9432068	0.03
326.1783447	2.19
328.0697327	2.97
328.7658386	0.04
330.9818115	0.10
334.2919922	0.10
335.9754639	0.04
338.2338867	0.04
340.2804871	0.25
346.1450500	81.89
347.1234741	1.96
349.9670410	0.11
352.0150452	0.40
355.2274780	0.18
358.1406860	1.21
360.0847168	0.11
361.0525513	0.16
372.3994141	0.10
375.1341553	0.14
379.2022095	1.23
380.3207397	0.40
380.9736023	0.10
388.5436096	0.20
390.1443787	35.92
391.1550598	0.47
392.2629700	0.08
393.1869202	0.54
395.1094360	0.03
396.1905518	0.03
404.6097107	0.06
405.5596619	0.03
406.5176697	0.14
407.1647949	0.17
409.1575012	1.29
409.9913025	0.69
411.0570679	8.99
416.3726501	0.09
418.3443298	0.43
419.1098633	0.97
420.1488647	0.83
423.0551758	0.27
428.4375000	0.05
432.2476501	0.03
434.2078247	4.51
436.9865112	1.94
452.1325378	100.00
452.7539062	0.13
454.4555054	0.40
455.1859741	1.73
458.9562683	0.16
460.2655945	0.46
461.7067871	0.13
464.1635437	9.40
478.0846863	5.12
478.8890076	0.03
486.7113647	0.02
487.6269226	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	273.96
Annotation	Unknow
Peak:m/z	Relative Intensity
114.8579865	5.30
115.8392715	2.90
131.0237579	0.18
132.0030060	0.09
158.9195404	100.00
159.9370117	60.46
199.0207520	1.51
199.9913025	2.63
201.9347534	0.14
216.7940674	0.56
218.0445557	0.74
227.2616577	0.04
228.9530945	14.01
229.9038696	26.91
243.8308716	0.04
245.9660034	0.37
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	627.1268
Annotation	Unknow
Peak:m/z	Relative Intensity
184.3577271	0.04
192.9719391	0.04
194.1954193	0.30
199.0916443	0.33
226.2170715	0.19
228.4705811	0.10
231.0366211	0.19
234.9354248	0.11
238.8818359	0.08
243.1678467	0.31
244.9562988	0.21
256.2818298	0.03
259.2212524	0.06
260.3233032	0.07
271.0932617	0.26
272.9785767	0.03
283.3186035	0.46
284.0949707	0.15
285.3040161	1.71
301.1925049	0.39
302.1329956	0.09
303.3168335	3.22
305.1932373	5.16
312.8779907	0.05
315.2528992	0.16
315.9799194	0.10
323.1566772	4.89
324.8895569	0.20
335.0632935	1.94
337.1897583	0.15
347.3017578	0.06
349.1878662	0.16
352.1820068	0.05
360.1444702	0.25
363.1345825	0.09
366.5709839	0.10
367.2210083	0.25
370.1937866	0.10
377.8904419	0.33
384.1246948	0.36
389.1627808	0.30
391.6076050	0.24
406.0997925	0.60
411.1837769	0.04
417.0560913	0.13
418.3305664	0.53
421.1409302	0.16
423.0586548	0.19
424.1453857	1.99
425.6124878	0.22
426.3418579	0.05
429.5158691	0.05
434.1713257	0.26
435.2052002	0.29
442.8666992	0.05
444.5307617	0.10
446.7307739	0.08
452.0665283	0.12
457.2246094	0.16
462.9732666	0.28
464.1548462	0.34
472.3898315	0.12
479.7636108	0.83
480.3972168	0.07
481.2114868	0.59
485.0288696	0.18
490.2340698	0.08
498.1846924	100.00
501.2626343	0.14
513.1940308	0.82
521.0491333	0.10
534.9563599	0.36
536.5868530	0.19
537.4165649	0.07
539.2745361	0.18
546.1181030	0.24
551.2830811	0.06
553.1386719	0.24
554.0933838	0.14
564.1177368	0.23
565.3694458	0.59
566.5261230	0.20
571.4220581	0.66
580.5839233	0.24
581.5545044	0.10
583.3625488	5.09
586.3098755	0.28
591.1705322	0.51
595.1713257	0.03
608.7346191	0.51
609.3699341	2.57
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1140.27
Annotation	Unknow
Peak:m/z	Relative Intensity
379.8533325	0.01
631.4318848	0.02
941.1750488	0.00
987.9329834	0.04
993.1665039	0.03
994.2778320	0.01
1030.6630860	0.01
1127.1110840	0.12
1306.3146970	0.03
1379.2122800	0.02
1380.1024170	0.06
1996.6232910	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	547.9968
Annotation	Unknow
Peak:m/z	Relative Intensity
168.8792267	0.41
170.1129150	0.09
187.2408295	0.06
188.1313934	0.10
191.0457306	0.05
197.0378571	0.47
197.9489136	0.22
205.2575836	0.08
208.2376251	0.08
210.8434143	0.02
213.2364197	0.11
214.0348816	0.40
214.9252167	3.50
215.9553528	0.32
223.0141296	0.08
225.2674866	0.15
234.0243988	0.46
245.3561096	0.05
247.1831207	0.43
249.9983826	0.09
253.0940857	0.03
260.2565308	0.15
267.2375183	0.15
271.2290039	0.38
271.9048462	0.21
272.5911865	0.14
283.0911255	4.54
285.0487061	0.22
287.2430115	1.16
290.4336243	0.05
292.2368774	0.39
293.4100952	0.16
295.4815063	0.35
298.3758545	0.04
299.0910034	0.46
303.2322388	2.51
304.1700439	0.38
307.6585083	0.26
309.4552002	0.05
310.5482178	0.43
312.0455933	0.42
315.1673584	0.69
316.1596069	0.29
318.9860229	1.26
319.6918335	1.07
320.4532471	0.09
322.8071899	0.10
324.8173218	0.13
326.5366821	0.55
335.1450806	0.64
336.2672729	0.18
336.9057007	0.17
340.0720215	1.59
341.0932007	0.33
342.1525879	0.19
346.8045654	0.17
354.0986328	0.38
356.0606079	0.83
357.0631104	0.71
359.1516724	0.17
360.3059082	0.07
363.0095825	0.67
363.8872681	0.19
365.0335693	0.10
368.0455322	0.13
369.2206421	0.10
370.0892334	0.41
372.1098022	100.00
373.1715698	7.39
373.9777222	0.73
374.8632812	0.49
375.6481323	0.45
376.5480957	0.03
379.2224121	0.09
380.7653809	0.05
382.2245483	0.11
383.9355469	0.15
384.5645142	0.13
387.1315308	0.13
388.1284180	2.93
389.3312988	0.42
390.1290894	2.67
391.0225830	1.39
392.3742065	2.17
393.1812744	0.07
393.8005371	0.43
394.6041260	0.11
396.9924316	2.23
400.5774536	0.27
403.8967896	0.35
406.2007446	0.08
406.9455566	0.18
408.6433105	0.15
410.1922607	1.33
411.1833496	0.77
414.5117798	0.22
415.1473389	0.03
417.3429565	0.05
421.1085815	0.08
423.0578003	0.56
424.0180664	1.06
424.8047485	0.73
426.1935425	0.80
427.2533569	0.71
430.8269653	0.51
432.2204590	0.25
432.8663330	0.21
433.8046265	0.06
437.4367065	0.16
438.9830933	0.10
440.1567383	0.15
441.0890503	0.07
442.1250000	0.12
443.2282715	12.85
444.2422485	0.69
445.4518433	0.11
447.1796265	0.25
449.0778198	0.04
449.8787231	0.20
454.9308472	0.78
456.7321167	0.79
457.6140747	0.48
459.2725220	1.74
460.5098267	0.05
461.4010010	0.13
463.1265259	1.50
464.9714966	1.25
466.2055054	0.35
467.0153809	0.19
468.9801025	0.13
472.6864624	0.25
473.9913330	0.47
475.0380859	0.81
476.0350952	0.23
479.1403809	7.00
480.2061157	0.75
481.0220947	0.41
484.8285522	0.09
486.2070923	0.21
489.8324585	0.20
491.2385864	0.42
493.0574341	0.10
494.4044800	0.64
495.0777588	0.75
495.9649658	0.43
497.1647339	0.09
497.9492798	0.79
498.9653931	0.14
499.8606567	0.04
500.9025879	0.14
503.0770264	0.45
504.0824585	0.17
504.9257812	1.31
506.0449829	2.79
506.9219971	0.18
508.0153198	0.13
510.9298706	0.07
512.0233154	0.49
512.9125366	0.26
513.5228882	0.34
516.0475464	3.50
517.1247559	1.15
519.0599976	0.03
521.0269165	0.07
521.8188477	0.15
524.9911499	0.03
528.7613525	4.50
529.8954468	0.82
530.7780151	1.01
531.4091797	0.36
532.8358154	0.59
534.5673828	0.44
536.2193604	0.28
537.5371094	0.45
539.2400513	0.21
540.0753784	0.12
550.6686401	0.20
552.8699951	0.09
557.2084961	0.19
560.9093628	0.03
564.8835449	3.31
566.0271606	6.10
566.9651489	1.98
568.0324097	0.23
574.9213257	0.06
576.7119751	0.11
578.8858643	0.99
579.8278198	0.09
581.0130615	0.06
597.4362183	1.13
598.0669556	1.67
598.9916382	0.53
604.9786987	0.68
607.0238037	0.15
609.9003296	0.12
610.9632568	0.36
612.1315308	0.09
612.9392700	0.24
628.9974976	0.35
629.8457642	0.10
639.0312500	0.35
639.8367310	0.12
669.1325684	0.11
670.4595947	1.49
671.1077271	1.61
671.8848267	0.81
681.8078003	0.17
702.6708984	0.24
711.1163940	0.07
742.8582153	4.02
743.8293457	1.33
744.9938965	0.49
774.5655518	0.69
775.2741089	0.10
807.0173340	0.73
896.9735718	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	346.1078
Annotation	1,2-Dimethoxy-13-methyl-[1,3]benzodioxolo[5,6-c]phenanthridine
Peak:m/z	Relative Intensity
128.0295868	8.22
143.0567322	5.30
145.1468201	0.52
146.0801544	0.17
151.1904907	0.15
153.1378326	0.21
155.0065613	0.35
166.2156372	0.82
167.1051636	0.82
168.1378784	0.07
170.9047089	1.52
179.0818024	10.84
182.8303528	0.17
184.2347717	0.12
185.2224121	0.10
191.7393341	0.06
193.1457520	0.09
197.1186066	0.95
210.1194763	7.80
211.0834045	0.11
212.8283539	0.22
217.1486206	8.31
219.0128784	0.26
223.1758423	0.43
225.4648438	0.23
226.2818298	0.21
228.2198181	0.34
236.2261658	1.20
240.1745911	0.18
241.9866943	0.15
253.1393738	2.43
254.2102356	100.00
256.1229248	0.20
258.1049194	0.92
259.0307617	1.26
267.2070618	0.07
268.1507568	0.13
272.1876221	71.05
302.0821838	0.26
304.3309326	0.16
305.0332642	0.13
328.1717529	57.64
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	939.2569
Annotation	Unknow
Peak:m/z	Relative Intensity
363.2626953	0.23
525.2391357	0.46
687.4159546	1.28
688.6124268	0.10
705.4346924	0.87
777.4512329	0.08
849.6022949	1.84
850.8186646	0.17
858.5189819	9.50
859.1766357	0.06
860.3248901	0.15
867.4104614	0.28
868.3166504	0.31
872.0474854	0.06
938.7714233	0.08
1011.4340210	0.69
1012.2616580	0.38
1013.2379760	0.17
1029.4765620	3.07
1030.3306880	0.98
1173.4873050	1.25
1174.4301760	0.93
1191.3306880	3.30
1192.4965820	1.08
1335.3619380	1.03
1336.6041260	0.65
1353.6014400	2.75
1354.5166020	1.59
1497.6470950	0.46
1498.6064450	0.21
1515.5489500	5.32
1516.6895750	0.53
1517.8299560	0.05
1659.4377440	0.06
1660.7349850	0.18
1677.5350340	6.80
1678.7066650	2.38
1679.7711180	0.28
1684.7974850	0.20
1839.6257320	100.00
1840.6419680	48.81
1841.7526860	4.48
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	356.047
Annotation	Unknow
Peak:m/z	Relative Intensity
103.0058212	0.03
104.9787445	0.12
114.0153503	0.04
117.9848557	0.05
125.9381561	0.05
127.0222092	0.03
127.8712921	0.11
133.6347961	0.15
136.8903809	0.83
142.1464996	0.03
148.1351776	0.02
149.1550140	0.01
153.0070496	0.04
158.1181641	0.09
159.9845428	2.69
163.1012115	0.02
165.1516418	0.02
166.2143860	0.02
173.2022095	0.06
178.9002533	8.57
181.1325989	0.01
187.1798248	0.10
189.7000732	0.04
191.9702911	1.91
193.8684082	0.11
200.0728760	0.04
207.5763550	0.10
208.5105286	0.05
210.0678101	0.05
213.9927673	0.06
215.7999878	0.08
217.1453247	0.02
217.8792114	0.10
224.0992126	0.52
226.0012817	0.13
227.2532959	0.04
227.9416504	0.01
232.1472168	0.25
233.9613037	0.14
237.7288513	0.05
243.3658752	0.07
244.3084106	0.02
248.0498352	0.02
249.9603577	1.87
250.6031494	0.05
252.0520630	0.02
255.9671021	0.15
261.4411316	0.09
263.9407654	0.11
265.9331360	100.00
269.8969421	0.08
273.1128540	0.14
274.8824463	0.07
276.0336609	0.02
279.1994019	0.08
280.0417480	0.06
281.9547119	0.88
283.2150269	0.09
284.3216858	0.08
291.4257202	0.06
292.0454712	0.01
295.3638916	0.04
297.4338989	0.19
298.1244812	2.21
309.2910461	0.18
310.2599182	0.09
315.0996094	0.25
316.2631836	0.02
321.1848755	0.10
322.8528748	0.25
323.8566284	0.36
327.2990112	0.14
328.0782776	0.12
333.0394897	0.07
337.2897644	0.63
338.1656494	0.03
339.3482666	0.05
347.1738586	0.10
351.1856689	0.11
355.3868103	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	680.2076
Annotation	Unknow
Peak:m/z	Relative Intensity
215.1691589	0.10
221.1626740	0.07
251.1007690	0.11
310.9806519	0.08
323.2760010	0.45
338.0167236	0.12
341.0232544	0.65
383.4364014	0.03
477.2402954	0.03
485.2854614	0.09
503.2111816	100.00
504.1320190	0.42
505.0546265	0.04
506.2030640	0.01
518.1992798	0.08
545.6575317	0.10
590.0868530	0.09
592.3359985	0.05
622.1019897	4.79
622.7572632	0.05
632.5126343	0.05
635.5374146	0.04
639.1959839	14.89
657.0075073	0.11
662.3805542	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	365.14
Annotation	Gln Ser Met
Peak:m/z	Relative Intensity
116.9645538	0.14
129.9866791	0.05
142.1734619	0.22
149.1311035	0.18
162.0065918	0.48
166.0756531	0.09
172.1196899	0.09
177.4656982	0.12
183.1898193	0.13
186.3109741	0.28
190.9046326	0.24
200.2390594	0.42
200.9595184	0.08
203.2470703	0.13
205.9409485	0.04
208.0781403	0.09
215.6454315	0.31
216.8796082	0.12
220.0132751	0.13
221.0057068	0.05
227.2489014	0.06
239.6167603	0.25
243.3480835	0.10
244.2540283	0.06
252.8023682	0.07
253.4166565	0.12
257.0130005	0.10
259.2999268	0.06
269.1545715	0.13
270.8989258	0.66
273.1303711	0.12
275.1824341	0.38
276.1793823	0.18
276.9664917	0.17
283.2188721	0.09
301.5143738	0.38
302.37854	1.07
303.09375	0.71
313.9634705	0.14
315.8931885	0.06
319.1345215	0.40
320.2519531	1.01
321.0770874	0.21
324.062439	0.14
329.182373	0.24
347.1454163	100.00
347.7949524	0.57
355.6113281	0.19
356.2802429	0.16
365.2548828	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	182.0807
Annotation	4,6,7-Trihydroxy-1,2,3,4-tetrahydroisoquinoline
Peak:m/z	Relative Intensity
87.6628342	0.06
136.0274506	22.35
147.0106964	0.07
164.9506989	100.00
167.3510590	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	261.15
Annotation	Cordiaquinol J
Peak:m/z	Relative Intensity
87.05754089	0.16
93.00517273	0.03
98.80727386	0.04
145.2198944	0.05
147.0355682	0.05
148.1199493	0.04
153.2690735	0.06
158.9450684	0.20
163.1104584	0.26
181.1572723	0.14
182.7765045	0.09
191.0568542	0.04
199.187088	0.13
202.8265686	0.09
215.1137085	0.63
217.0246277	0.22
221.0150299	0.09
225.0446777	0.05
233.2429657	0.19
233.864151	0.07
243.1483154	100.00
244.0240326	0.12
245.1829834	2.86
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2419
Annotation	Moniliforminol A
Peak:m/z	Relative Intensity
84.80294037	0.42
94.99625397	0.49
97.02219391	0.86
98.88903046	0.13
100.7926178	0.12
109.0086136	0.42
122.8396759	1.51
124.8366165	0.30
134.9081726	0.60
136.9815979	0.54
139.0046387	12.85
142.8548279	0.35
152.7489319	0.37
155.1378479	0.11
157.1201019	0.55
166.899353	0.96
169.0506134	0.90
171.0670013	0.73
176.9741058	0.24
179.153656	1.30
181.1634064	0.62
183.0922852	0.11
185.1507263	0.31
189.0332336	0.72
190.150177	0.29
195.2373047	0.30
196.420929	0.94
197.1421814	4.03
198.9288025	1.30
208.3529053	0.65
209.0579224	0.26
211.0635986	2.52
213.2233887	0.54
217.5741577	0.55
219.0823059	0.42
221.2477112	1.48
223.3249817	0.64
225.0984192	0.50
226.9941101	0.21
229.2593079	0.69
233.036438	1.19
235.2458191	0.21
237.2348633	2.23
239.205719	15.58
241.2095337	0.56
242.9941406	2.51
251.3641663	1.56
253.22995	1.74
255.1812744	0.95
255.9634399	0.40
257.1471252	2.22
261.240448	3.20
269.1320496	0.31
279.2407227	100.00
280.0682983	0.28
281.2306213	3.63
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	272.0888
Annotation	Unknow
Peak:m/z	Relative Intensity
85.9884262	0.43
87.9370041	0.11
99.0313721	0.74
102.0269470	0.08
108.9036865	0.08
112.9925842	0.03
127.9659119	16.33
133.1464386	0.06
136.0128021	0.10
142.9342194	21.03
145.0686493	2.21
145.9927063	3.13
153.9751434	1.63
159.9510040	0.04
166.2131500	0.44
167.1071320	0.39
170.0482635	0.18
171.1064758	0.20
179.0157318	21.07
180.3583984	0.05
181.1341858	0.06
185.1147308	1.66
193.1162262	0.03
196.4156036	0.16
197.1044464	1.91
198.1342926	0.11
199.1099091	0.12
210.1109161	13.20
211.0081329	0.13
224.3204041	0.02
225.7215729	0.12
228.0627899	2.07
236.1002655	0.54
241.8776245	0.12
243.8545380	0.09
254.1454926	100.00
255.1501007	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	359.1263
Annotation	Eupaglehnin E
Peak:m/z	Relative Intensity
120.0283966	0.16
120.9549713	0.10
121.8574905	0.12
123.1075897	0.84
132.6047821	0.18
141.0143280	0.30
143.0572815	0.31
149.0420227	0.28
150.1696167	0.95
151.0148315	0.30
159.9183044	0.74
170.0795593	0.32
172.0571136	0.41
175.2392273	0.14
178.0329437	100.00
180.0957336	6.25
181.0935669	1.21
182.0770569	7.05
183.0862122	0.60
184.2604065	0.30
193.0649719	0.24
196.0994263	22.37
197.0982056	6.40
198.1806030	0.39
200.6148682	0.65
201.2744904	0.34
210.2038574	0.54
222.2139893	0.12
228.3743286	0.15
229.1936035	0.16
230.2670593	0.14
239.2468567	0.21
242.2003479	0.46
244.2551880	1.95
245.5150452	0.13
252.0624390	0.69
253.3603821	0.61
254.5056458	0.19
256.3130493	0.43
257.4670715	0.46
258.4303589	0.35
269.8226318	0.39
271.1476440	0.38
272.1875305	1.20
281.2284241	1.26
282.3140259	0.38
286.3040161	0.14
288.6223450	0.10
296.1290894	0.85
297.1841431	1.70
298.1318970	1.91
299.1935425	4.18
300.1376648	0.11
312.9108276	0.14
314.0796204	1.30
314.9298096	0.53
316.1507568	0.36
317.4674377	0.52
323.0780640	1.14
328.2086182	0.16
330.2443237	0.24
331.1740723	1.07
340.2856140	2.18
341.2322083	2.65
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1081.5463
Annotation	Tomatoside A
Peak:m/z	Relative Intensity
594.9334717	0.03
595.6021118	0.32
637.3498535	0.05
739.3856201	0.04
755.5615845	0.02
757.5490723	21.96
758.1829224	0.08
797.1805420	0.01
799.4923096	0.02
827.6614990	0.01
837.9040527	0.02
852.9328613	0.03
900.4747314	0.03
901.5406494	0.71
917.3005371	0.01
919.5334473	100.00
920.2027588	0.42
961.7055664	0.03
1063.1678470	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3alpha,5beta,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
97.05871582	0.22
98.91842651	0.27
100.7147675	0.20
102.9647064	0.09
104.8829803	1.17
106.9002686	1.47
108.953186	0.58
110.9587402	1.66
112.0695267	1.62
112.9142075	16.85
113.8129578	0.36
114.8458557	1.28
116.8517838	0.04
118.9916611	0.37
121.0297928	2.75
122.9670486	0.39
125.1982803	0.18
126.8137207	0.30
128.9883423	6.10
130.0711365	0.25
130.9667053	1.48
133.0063171	0.94
135.0769043	1.46
136.864151	3.43
139.0431671	0.71
141.0358124	0.07
142.9458923	3.07
144.3777466	1.41
145.0323486	21.69
146.9660187	1.34
148.9664917	0.39
151.0076294	0.87
152.0491638	0.10
153.0921326	1.00
153.7163544	0.12
154.9346008	1.65
157.0061951	1.40
158.9718933	1.31
160.9367371	2.41
161.75177	0.19
162.9514465	4.38
167.0579224	0.12
169.0644989	1.15
170.9946289	0.63
172.9387817	1.68
175.0283508	1.86
177.0024872	2.86
177.8902893	0.43
179.3155975	0.33
183.025238	0.77
185.0173645	1.62
187.0828094	2.30
189.1157684	0.27
189.8453827	0.13
190.7771454	0.17
192.9874878	0.83
194.9678345	6.37
197.0783539	0.37
201.0812073	0.52
203.0322113	3.73
205.1648254	0.37
207.3567505	0.40
209.1308289	0.36
210.0205383	0.63
211.1876831	0.24
216.9929199	1.17
218.1206665	1.23
218.8708801	22.12
219.5200195	0.04
221.2081604	0.06
223.2315369	1.11
224.015625	0.08
224.9893799	0.38
226.8974304	1.65
228.806366	0.27
231.388031	0.13
235.0383301	5.27
235.8097229	1.79
237.0860901	0.20
241.3726807	0.07
243.0862427	0.14
245.3009644	1.13
247.3464355	3.19
248.5044861	0.11
249.1350403	0.29
251.095459	0.35
253.106842	0.17
259.225708	0.97
260.9970093	0.04
265.2918091	0.72
266.8693848	26.39
267.5527649	0.06
269.0032349	0.09
271.2852173	0.22
272.9767456	0.05
275.4290771	0.04
277.3830566	0.36
279.2497559	0.13
282.7941284	0.77
283.4299927	0.22
285.1529541	0.47
287.4159241	0.38
288.0910034	0.23
290.7704163	0.86
293.696991	0.15
295.2244263	0.87
297.2962952	0.44
299.286499	1.94
305.2572632	2.94
313.2528992	0.55
316.7428284	0.04
323.2471313	100.00
323.9998169	0.70
325.2472839	0.33
326.1486816	0.06
340.990448	1.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	478.2941
Annotation	PC(15:1(9Z)/0:0)
Peak:m/z	Relative Intensity
139.8594971	0.06
196.1557007	0.46
213.2883606	0.06
214.0492859	1.66
226.0851440	0.13
229.6945648	0.09
253.1940613	1.72
259.5924683	0.12
279.3766479	0.14
281.2930603	100.00
281.9482117	0.34
293.3675842	0.21
348.0195618	0.21
351.2088623	0.16
352.5556030	0.07
388.1398315	0.05
417.3159485	0.18
418.2432251	0.09
420.5465698	0.09
431.8219910	0.31
442.3109436	0.48
443.2016296	0.11
459.0476379	0.15
459.9830322	0.84
460.8706360	0.46
462.9249878	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	315.2543
Annotation	CHEBI:79290
Peak:m/z	Relative Intensity
108.9060898	0.24
142.0718994	0.19
151.0649414	0.10
185.0613098	0.37
186.8660431	0.22
199.0194702	0.20
202.9529114	0.30
211.3141174	0.15
213.204834	0.15
216.1990662	0.11
217.4389343	0.08
218.8348694	0.12
221.1600647	0.85
225.4093323	0.08
227.2528381	0.22
233.0577087	0.11
235.3004456	0.43
239.402832	0.12
240.6263733	0.19
241.2525635	0.28
243.0888367	0.60
250.5579834	0.06
253.2628174	100.00
254.4928894	0.27
255.1474609	0.54
258.3170166	0.08
268.4919739	0.28
271.0499268	1.87
272.0270081	0.12
273.3309021	0.14
274.071991	0.30
279.3113403	0.39
281.3994141	1.21
282.083313	0.11
287.1995239	0.14
295.390686	0.32
297.2477417	73.36
297.8800049	0.33
298.9931641	0.51
299.9487915	0.11
301.2225952	0.25
315.4245911	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2416
Annotation	Moniliforminol A
Peak:m/z	Relative Intensity
94.90804291	1.25
96.87991333	0.72
99.00343323	0.74
106.862709	1.00
108.7647324	2.31
111.1789398	1.57
112.8205948	0.22
114.9546661	0.22
121.135849	0.13
123.0790939	2.10
124.9168777	0.65
127.0063705	0.12
131.012085	1.05
133.299057	0.25
134.9811096	1.14
136.8443756	1.30
138.9991455	6.24
140.9927063	0.43
143.102356	0.34
147.2071228	2.14
149.1679993	0.30
151.2172852	1.97
153.1615295	1.25
155.0556335	0.46
157.1706238	0.54
159.0827026	0.37
161.0814667	0.71
165.1401672	0.26
165.9420166	0.22
167.0812988	0.86
169.0106659	1.26
170.0225677	0.28
171.0822144	0.92
172.2507935	0.64
173.1694946	0.41
175.0862274	0.97
176.0192871	0.23
177.2565918	0.46
180.9359131	0.40
182.8708496	4.67
185.3057251	0.20
188.9325867	0.19
191.1721497	0.20
193.1524353	0.44
194.9860229	1.24
197.109314	4.31
198.9990234	0.78
203.09552	0.95
207.1307678	1.19
208.9753723	0.16
209.8827515	0.41
210.9729004	0.54
213.169281	1.72
219.1223145	2.05
221.1238403	2.79
222.662323	1.48
223.3623962	0.18
224.0018921	1.35
225.1956787	1.35
227.1747131	0.17
233.1740112	1.37
237.1924744	3.61
238.0057068	0.19
239.1465149	10.18
241.3497925	1.01
243.4006348	3.28
245.5299072	1.27
251.1463928	4.22
253.0565186	2.44
255.2948608	1.40
256.0496216	0.67
257.1292725	0.54
261.1962585	8.54
269.1192932	0.77
276.0547791	1.04
279.2390137	100.00
280.1872253	0.60
281.0034485	1.51
287.4183655	0.54
298.7106323	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	855.256
Annotation	Sesaminol glucosyl-(1->2)-[glucosyl-(1->6)]-glucoside
Peak:m/z	Relative Intensity
258.9937439	0.07
299.0053406	0.02
305.1690063	0.01
323.3387756	0.02
337.1153564	0.21
355.3245850	0.04
387.5212402	0.04
390.9354858	0.03
435.2321167	0.03
481.2982178	0.06
485.6638184	0.21
499.2509766	12.14
500.3251343	1.17
505.2186279	0.04
531.1995850	0.56
532.7134399	0.07
573.4170532	0.07
580.9390869	0.13
581.5878296	0.02
593.9083252	0.01
661.2116089	0.04
670.3712769	0.01
675.3257446	0.05
689.4909058	0.09
693.2213745	100.00
694.1885376	14.54
695.1165161	0.09
708.0372925	0.03
725.4488525	0.07
726.5005493	0.04
735.2537842	0.73
736.3851929	0.41
747.4658813	0.17
765.0892944	0.18
765.7892456	0.05
793.3330688	0.02
795.0204468	0.16
796.2583008	0.04
801.3300171	0.06
805.2903442	0.04
811.4127808	0.06
815.0479126	0.09
826.0738525	0.01
836.3073120	0.05
837.1304321	0.33
838.0803833	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	478.2916
Annotation	PE(18:2(9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
149.2104340	0.11
151.2622986	0.02
154.7842712	0.05
161.1750488	0.13
162.9661255	0.09
164.9644165	0.03
167.1760101	0.04
173.0220337	0.09
175.2543793	0.07
179.1786194	0.15
193.1691895	0.12
198.1033020	0.17
201.3008118	0.08
216.0966492	0.35
245.1581268	1.01
263.2108154	3.75
263.8403625	0.02
265.0430298	0.06
292.9142456	0.09
301.2955933	0.03
306.2673035	1.03
307.0580444	0.07
315.1545105	0.04
319.4354248	0.22
321.4553223	0.23
324.5094299	0.10
335.3468628	0.10
337.3837891	55.47
339.5142822	0.04
346.9361572	0.08
380.6116638	0.24
388.7586670	0.21
402.1849670	0.02
416.2648010	0.08
417.1519775	4.84
430.8825378	0.03
432.2888184	0.12
433.3719788	0.04
435.2387085	0.39
447.0019226	0.11
460.2395630	100.00
461.1592102	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	595.3824
Annotation	Dioseptemloside B
Peak:m/z	Relative Intensity
197.1255188	0.54
230.1665955	0.43
243.1963806	0.62
253.2484894	2.92
255.1442261	1.56
266.2554016	0.22
268.8827515	0.23
271.3201904	24.41
283.2629395	1.18
288.6936035	3.71
289.3165894	12.87
296.9888306	0.71
301.3097534	1.15
303.0678711	0.89
328.4650269	0.65
347.309021	5.46
379.6261597	0.32
388.2710571	1.24
397.2520752	0.47
399.930603	0.71
415.3178711	4.07
433.3294678	100.00
434.008667	0.68
447.1637573	0.19
449.3129272	0.26
450.984314	0.31
492.7553711	0.83
505.088501	1.53
505.921814	0.39
507.3051758	1.26
530.8851929	0.52
537.5274048	0.14
541.4616699	1.60
549.5899658	1.88
559.4291382	1.53
577.293335	9.58
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	452.2782
Annotation	PE(16:0/0:0)
Peak:m/z	Relative Intensity
139.9334717	0.22
152.9689789	0.10
185.1592255	0.02
196.0263367	1.81
214.1237183	0.99
240.0547180	0.02
255.2613831	100.00
288.8913574	0.03
324.3140259	0.06
345.2360535	0.02
358.4378052	0.02
359.3262329	0.03
372.6014709	0.06
391.3652649	0.33
406.5393677	0.25
408.0817261	0.02
409.6968384	0.02
414.1804810	0.02
433.6766663	0.06
434.3117676	0.19
435.0854187	0.01
436.0686035	0.04
447.9143982	0.03
451.8305054	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	607.1575
Annotation	Unknow
Peak:m/z	Relative Intensity
178.9998779	0.26
183.0628052	0.07
195.6292267	0.06
196.5479279	0.29
197.1773987	0.07
209.7883453	0.08
222.1446228	0.11
225.2424927	0.08
247.0028687	0.08
247.9209290	0.34
263.2181702	0.19
266.1406250	1.68
270.8436890	0.20
278.3399353	0.06
288.3931274	0.14
289.0982056	0.16
294.1846619	0.05
295.1839294	0.12
299.3683472	0.20
302.8552246	0.08
316.9035034	0.15
329.2671509	0.16
335.3742065	0.07
337.4395752	0.12
339.4877930	0.52
340.2463379	0.87
341.1649170	0.40
353.0118408	0.21
369.1491699	0.58
371.1867676	0.38
373.0587158	0.20
374.2326050	0.06
381.3562012	0.10
383.3917236	0.04
389.2825317	0.33
390.4431763	0.06
402.3986206	0.04
403.2238770	0.28
406.2633057	0.15
413.3330078	1.13
415.2473755	1.66
416.0830078	0.10
417.2507935	0.18
427.2443237	2.02
430.2899170	0.24
431.3407593	0.19
439.4155884	0.14
441.1823730	0.05
443.4481201	0.27
445.1799316	0.06
447.2265625	1.56
451.3142090	0.43
459.1947632	5.51
464.1268921	0.50
470.7177124	0.87
471.3641968	0.78
473.3801270	0.59
476.0527954	2.70
477.0397949	0.12
478.3286133	0.13
478.9858398	0.16
481.1839600	0.20
491.0950317	29.03
493.2338867	0.23
500.5936279	0.35
505.1680908	1.15
508.0987549	27.88
508.9503784	0.11
517.1455078	11.92
520.5409546	0.13
549.0681763	100.00
549.6840820	0.91
561.2465820	0.05
562.4838867	0.28
566.0169678	48.87
566.6919556	0.31
568.7900391	0.08
569.4199829	0.08
588.3687134	0.21
589.1629028	1.83
597.4918823	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	522.18
Annotation	Unknow
Peak:m/z	Relative Intensity
162.8442383	0.17
165.9590759	7.31
196.4252930	0.06
198.0933990	19.06
223.0477142	0.08
239.0441895	0.51
240.2831726	0.12
255.1540833	0.09
265.0338440	0.14
276.3123169	0.07
278.9699097	0.38
293.1947632	0.19
294.2179260	0.12
298.3213501	0.05
310.1101074	0.58
313.3483276	0.14
314.1209106	0.08
324.1876221	1.46
328.0372314	0.89
333.0891724	0.08
342.2039185	2.30
343.1007690	0.04
345.0484619	0.26
360.2406616	100.00
385.1873169	0.04
402.1541748	1.28
418.3170166	0.28
429.9837646	1.08
432.2631226	0.08
438.2391357	0.54
444.3548584	0.15
447.1928711	0.14
448.1141968	0.05
463.0819092	0.03
486.2655640	2.12
487.2055054	0.04
490.1685181	0.44
504.1943970	7.38
505.1774902	0.95
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	284.0983
Annotation	Crotonoside
Peak:m/z	Relative Intensity
94.8932495	0.01
108.9718018	0.05
113.1686707	0.01
127.0403214	0.03
132.8987732	0.02
134.8759460	0.03
149.0532684	0.02
151.9581604	100.00
152.7693787	0.01
155.0699615	0.01
163.0989838	0.01
182.0300446	0.02
195.2809448	0.06
195.9840088	0.01
218.1559448	0.04
221.9172058	0.01
225.0972900	0.01
237.6844788	0.02
247.3804016	0.07
248.0130615	0.06
248.7343140	0.01
253.0270996	0.01
263.8047485	0.04
265.2768555	0.11
266.1249695	0.02
267.4116211	0.03
275.7578125	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	277.0863
Annotation	Methionyl-Glutamate
Peak:m/z	Relative Intensity
127.9672470	100.00
148.0389709	1.70
173.2942963	0.04
215.0690613	0.17
229.2838440	0.05
241.1454468	5.24
259.0751343	69.65
260.0204468	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	413.1404
Annotation	t(6)a
Peak:m/z	Relative Intensity
119.0529099	0.04
120.0758896	0.10
122.1582413	0.06
136.0201569	0.37
145.1559296	0.06
146.101593	0.05
147.1023712	0.07
162.0657043	1.16
163.0276184	0.20
164.0595703	0.14
165.9312439	0.03
179.1359863	0.04
188.0254059	0.07
188.7569275	0.02
191.8753204	0.02
194.1962585	0.07
204.9774475	0.67
206.0643158	0.21
207.2939911	0.03
209.3590546	0.04
220.0277405	0.02
231.437561	0.03
250.1371765	0.07
250.8595581	0.03
253.2080688	0.04
263.1856995	0.03
265.1602173	0.02
266.1795044	0.02
268.2038269	3.14
273.1645813	0.05
275.0515747	0.03
281.098938	100.00
282.1412354	0.43
283.0310669	0.36
284.0737	3.12
291.2018433	6.20
292.1115723	1.24
293.1824951	3.53
294.2311096	0.83
298.1811218	0.06
302.1869507	0.09
323.3546753	0.12
324.9300232	0.02
325.6602173	0.03
339.4255066	0.15
346.1392822	0.06
348.1016846	0.04
350.2288208	0.18
353.9452515	0.04
366.1029663	0.02
367.6591492	0.16
368.9963684	0.10
374.2254028	0.11
376.7860413	0.08
379.3375244	0.06
381.9918823	0.02
385.0390015	0.15
392.0588684	0.08
395.2266541	0.77
396.2134705	0.08
404.9331055	0.04
412.3971863	0.02
413.5522766	0.07
414.5174866	0.02
424.1425781	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	256.0995
Annotation	Unknow
Peak:m/z	Relative Intensity
130.2258453	0.03
134.2053223	0.03
166.0223999	100.00
166.8087616	0.09
193.1385345	0.01
205.9350739	0.04
238.0593719	0.08
239.2331390	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	632.2042
Annotation	Atalanine
Peak:m/z	Relative Intensity
178.5259094	0.01
179.2094116	0.09
232.7286682	0.11
250.8560944	0.11
280.5000610	0.03
290.0463562	0.05
323.1887817	0.82
341.0173340	0.67
351.1981201	0.03
383.6426392	0.03
394.1710815	0.07
399.3614502	0.03
440.0396729	0.08
441.1721802	0.04
470.3013306	0.14
485.1262207	0.05
503.2380981	100.00
503.8463745	0.40
506.4550781	0.03
541.9713745	0.05
543.2296143	0.06
544.1709595	0.17
555.2931519	0.09
556.4568481	0.04
590.8377686	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	671.0569
Annotation	Unknow
Peak:m/z	Relative Intensity
204.3253021	0.14
216.9540710	1.24
223.2162476	0.08
240.9609375	1.17
256.9927368	3.68
258.0932617	0.55
274.0592346	0.15
305.8029480	0.18
337.0083618	0.29
347.0250244	100.00
385.3181763	0.30
405.0670166	0.11
414.2085571	0.35
418.9721069	0.18
427.9417725	0.22
432.3043213	0.07
455.6096191	0.23
457.0349121	0.07
459.1227417	0.31
472.2399292	0.18
480.1545410	0.12
490.1037598	0.23
492.8402100	0.19
540.4562378	0.15
567.4097900	0.20
572.5098877	0.18
580.0446167	0.07
581.2610474	0.21
595.3460083	0.30
611.2955933	0.16
615.2463989	0.22
616.3693848	0.35
624.9519653	0.09
627.1679077	0.05
629.1766968	0.23
641.0410156	0.23
653.1826172	0.54
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	989.3234
Annotation	Lantanose B
Peak:m/z	Relative Intensity
281.0809631	0.32
287.3550415	0.06
305.0839233	0.51
322.1705933	0.16
323.1565857	2.39
339.1528320	0.18
341.2356567	0.93
359.0173645	0.45
377.1767578	0.12
381.1172791	0.16
383.2477417	1.20
413.3304443	0.15
430.8413086	1.28
442.9708862	0.07
467.3812866	0.27
485.2803955	2.60
502.7140808	0.08
503.3670349	13.41
527.2336426	1.15
545.3094482	10.48
573.2858276	0.19
575.3533936	0.27
587.4160156	0.34
604.6977539	0.10
611.1723633	0.13
629.5701904	0.38
645.4843140	0.11
647.2928467	5.66
665.3366699	1.72
689.2985840	0.34
707.3034668	100.00
719.5406494	0.53
731.2640381	1.14
731.8944092	0.17
749.2283325	0.43
791.5396729	0.21
809.2647705	6.54
827.3590088	24.37
829.9627686	0.10
869.3922119	0.57
971.3623047	0.35
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	327.04
Annotation	5-Fluorodeoxyuridine monophosphate
Peak:m/z	Relative Intensity
94.9612732	1.38
97.0146027	12.18
97.9022369	0.94
98.9408417	4.25
100.7230835	4.62
102.1535645	1.01
102.9817276	1.45
104.9136276	21.26
105.9899521	3.95
106.9095688	14.01
108.0566864	0.96
109.0695343	1.60
110.3108597	1.01
110.9557266	14.73
111.9203796	1.54
112.9615860	18.48
113.9623413	1.66
114.9934235	3.16
116.0213013	0.25
116.9073563	0.83
118.9694519	6.98
120.0136642	0.99
120.9150009	2.03
121.8590851	0.61
123.0573349	2.29
124.2300949	0.72
125.0375137	0.91
126.2631149	0.83
126.9872894	3.57
128.8816986	100.00
129.9527893	20.53
130.9820862	54.26
131.9892120	3.26
133.0134430	8.58
133.8995972	0.89
134.9619751	2.23
135.9672241	0.53
137.0066986	3.51
137.9188538	1.21
138.8641357	8.13
139.9979858	0.71
140.9607239	2.83
142.9320526	5.58
144.0138702	1.34
144.9770203	6.31
146.1306458	1.09
146.9135437	3.71
148.0596008	0.43
150.9740906	4.81
152.0478516	2.57
153.1041260	2.49
153.9115143	0.98
154.8719177	1.11
156.9680328	0.96
159.0287018	0.62
160.8802490	48.14
162.0025940	16.54
162.8895721	42.85
164.1234741	1.93
164.9973145	6.10
165.8578186	0.36
166.9958649	3.43
168.3378906	1.01
169.0816345	1.76
170.0155792	2.61
171.0159912	2.80
172.0534973	0.14
172.9710388	0.89
174.9511414	7.92
175.8583984	3.05
176.9680786	11.47
178.1372223	0.27
178.9958191	1.15
180.1521301	0.05
180.7757416	0.13
182.1009521	0.46
183.0539551	1.96
184.2339478	1.26
185.0417023	3.56
185.9163361	0.33
186.9702454	0.94
193.1371613	1.95
194.2082672	3.10
195.0135345	4.13
195.8688202	2.77
196.9537048	4.65
199.1834717	0.47
201.0787964	1.88
202.0480042	1.42
203.1125336	11.29
204.0980072	4.06
204.9851074	7.93
206.0185547	0.38
206.9987183	0.34
208.0973511	0.09
209.0961304	0.47
210.1546021	0.76
213.2275391	1.53
214.0713806	0.15
215.0381165	0.62
216.9611816	7.47
218.0061646	5.83
218.9387817	10.96
220.0148621	0.75
220.9692993	0.98
222.1556396	1.11
223.0058594	0.39
224.1413574	0.25
225.3609924	0.44
227.1044922	2.13
228.2214050	0.85
229.2321472	0.40
230.6802979	0.64
233.0148621	2.86
234.8984070	17.69
236.0744019	15.74
236.9306335	28.48
238.2229919	0.43
239.0716248	0.45
241.4281006	0.58
245.0846558	0.44
247.3014832	0.39
249.2568665	1.01
250.9296875	3.60
252.0886536	0.78
253.1624756	1.14
256.2204895	0.37
257.8777771	0.20
259.3499146	0.22
261.9313660	0.49
262.9013977	0.67
267.0296326	0.41
267.8019409	0.55
269.2285461	1.88
270.2062683	6.03
271.2379150	0.22
274.1195068	0.79
281.2835693	1.11
282.1154175	0.52
283.2508850	1.64
284.7078857	0.29
285.4752808	0.15
286.1815491	0.73
290.0910339	0.37
291.0358276	0.99
296.9049988	0.90
298.1674805	0.10
299.1400757	2.12
303.6272583	0.51
304.2743530	0.12
309.1147461	17.73
310.0507812	0.07
311.2928162	0.08
316.9188538	0.13
327.3161316	0.54
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	309.109
Annotation	Tyrosyl-Glutamate
Peak:m/z	Relative Intensity
110.0901794	0.12
127.9443130	100.00
128.7649841	0.09
146.2866364	0.42
146.9801025	0.26
152.1371460	0.07
161.0179443	0.16
167.0956726	1.66
180.0794220	3.28
221.4328918	0.06
246.1214600	0.27
247.2788696	0.11
249.9945679	0.07
262.9489441	0.15
264.5822754	0.14
273.0260010	1.55
291.1953735	84.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	489.2109
Annotation	Terretonin E
Peak:m/z	Relative Intensity
139.4132385	0.10
144.0522308	0.18
145.1001282	0.39
147.0072021	0.10
153.0523376	0.11
154.0388336	0.08
156.0297546	2.10
156.9829102	3.70
158.0952148	12.14
159.1854401	0.48
162.1563721	1.19
163.0745850	0.12
171.1146545	0.96
172.1558533	0.14
175.0400238	85.85
176.1092224	1.54
179.9023285	0.15
181.0305176	0.19
182.1100616	1.79
185.8115845	0.54
198.3547363	0.08
199.2642822	0.21
207.8378296	0.09
208.9697723	0.15
210.1210632	0.35
211.3639221	0.48
222.8093567	0.52
224.3673401	0.55
226.4346771	1.48
227.3768311	2.60
228.0434570	21.78
229.0358734	0.32
230.9694519	0.28
238.9877167	0.11
241.0921173	2.52
242.9700165	0.96
243.9711609	0.19
247.1895752	0.22
249.3102417	0.21
250.3092041	1.81
251.2316284	1.13
252.1948853	3.42
252.9797668	0.39
255.0780029	0.93
260.1903381	0.25
264.9020996	0.13
266.2135315	0.60
266.9750061	0.18
268.3550720	1.92
269.1881409	17.99
270.1118469	0.90
271.1422729	0.29
273.4782104	0.82
277.2620544	0.17
281.1535034	0.54
283.3274231	0.23
284.1860962	0.37
286.3659058	1.81
287.1099243	4.27
290.9668579	0.09
292.4689331	0.92
293.3320312	0.60
294.1040955	0.91
295.3062134	0.33
297.0120239	10.06
299.0217285	0.40
300.0962830	1.24
310.0665894	2.31
311.1455688	7.40
312.1361084	2.78
315.0487366	47.77
315.7398376	0.10
318.4168091	0.31
321.1867676	0.48
322.0989380	0.19
323.1737061	0.37
326.2108154	0.26
327.0047607	0.73
328.2285767	41.78
329.2583618	0.75
332.1774292	0.20
335.3474121	0.33
337.2222290	0.65
338.1785278	2.77
344.1911011	0.07
345.2785339	2.05
346.2304077	16.49
349.6722107	0.34
355.1370850	0.90
355.9841919	0.81
358.2347412	0.17
360.1492310	0.18
365.3306274	0.34
366.0661011	0.15
367.3481445	1.14
368.1780396	0.28
369.3224487	0.75
371.4074707	2.92
372.8582764	0.10
374.0729675	0.41
376.3092346	0.17
379.5847778	0.21
381.2968750	0.28
383.2893982	0.88
385.2614441	8.65
386.6429138	0.93
393.2071533	0.93
394.3020935	1.09
395.1973267	1.68
397.2732849	2.75
398.2711487	0.76
399.1575623	0.34
400.1615906	0.65
401.2554932	0.76
403.2430115	20.42
403.9580078	0.22
408.6080017	0.08
409.4487610	0.25
410.2953186	1.41
411.2415466	6.22
412.4196472	0.88
413.1190186	1.34
415.3287659	44.67
416.1298218	0.40
423.3142700	0.54
426.2789917	3.32
427.2735291	6.48
429.2803650	11.52
430.2509460	2.76
431.5870056	0.20
433.0290527	0.59
435.3862000	0.23
437.3946533	0.08
443.1403809	1.87
444.1300964	0.70
444.7560120	0.68
445.6621094	0.17
447.3233337	11.43
448.2814026	0.11
453.3262939	16.04
454.2540283	2.84
455.1150208	2.66
456.6510315	0.52
467.6586304	0.64
471.2951965	100.00
472.3141174	5.59
473.4103699	0.38
480.0212097	1.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	460.13
Annotation	Unknow
Peak:m/z	Relative Intensity
131.0281830	0.22
133.0070801	0.15
149.1688690	0.13
156.0103760	0.40
162.1869202	0.09
162.9753265	0.12
166.1085052	0.71
174.8987122	0.15
180.0462494	0.38
196.1067810	0.25
204.5455627	0.24
212.1275940	0.22
214.2591400	0.23
231.0286560	0.15
232.1478577	0.54
245.0606689	0.47
264.8978882	0.06
268.0670776	0.26
283.2943115	0.31
285.8934631	0.83
297.2790222	0.46
303.3102722	0.57
304.2439575	1.24
309.2698669	0.33
310.6404419	0.07
312.9483337	0.26
313.8834534	0.19
322.0156555	1.32
326.2876587	0.37
327.6828308	0.23
329.0241089	0.18
344.1527100	0.28
367.1694946	0.13
370.1806946	0.66
371.0969543	0.07
372.0528259	0.08
402.3870544	0.17
414.3251648	0.17
418.7814026	0.19
424.1185608	0.58
425.4235535	0.18
442.1105652	100.00
443.1934814	0.86
451.7545776	0.48
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	227.9823
Annotation	Unknow
Peak:m/z	Relative Intensity
81.1015472	0.05
98.1501312	0.03
110.1762695	0.02
111.1165314	0.11
121.1157227	0.07
121.8646698	0.04
126.9997406	0.02
133.9091949	0.03
134.9958191	0.11
144.1282501	0.03
154.2131958	0.02
157.2425079	0.01
157.8449707	0.02
171.3190460	0.02
173.4786072	0.13
175.3427582	0.04
183.3393555	0.03
184.0970917	0.02
186.8971405	100.00
191.1331635	0.36
197.0479736	0.04
199.0313110	0.04
204.7953033	0.64
207.5010681	0.13
209.0247650	0.16
210.0622253	0.14
211.1079254	0.06
227.6277618	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	320.12
Annotation	Salbutamol 4-O-sulfate
Peak:m/z	Relative Intensity
108.7463837	0.15
110.8110962	0.15
112.0552444	0.03
128.1158142	0.14
134.1184082	0.23
136.0288544	0.13
140.0860596	0.17
149.0221252	0.25
149.9242706	0.13
152.0293732	0.05
152.9890137	0.07
153.9340210	0.10
157.9694214	5.74
166.3497314	0.08
170.1932068	0.34
170.8698425	0.04
174.2485046	0.45
175.2066956	0.09
175.8754578	0.05
178.0377197	1.06
180.8072510	0.18
188.2845001	0.13
189.7242737	0.27
192.2957001	0.16
198.0448456	100.00
201.9007721	0.04
205.1068726	0.22
207.8001404	0.09
212.8238220	0.03
214.0526733	0.20
216.9308472	0.08
220.0125122	0.06
222.3142395	0.36
226.8305054	0.05
230.0485229	57.79
231.0649414	0.21
232.1955872	0.33
234.7955017	0.15
235.4186401	0.18
239.1362000	0.06
246.0175781	0.27
247.3757324	0.27
248.0680542	1.08
250.1183167	0.20
251.7860718	0.28
255.9844971	0.23
257.2475586	0.41
258.0488892	0.12
260.0089111	1.06
261.1066284	0.07
262.0668945	0.25
271.1067505	0.43
273.7828674	0.42
274.3864746	0.08
275.0571289	0.28
277.9249268	0.17
279.0915527	0.28
280.3273621	0.14
283.5932312	0.24
284.9418030	1.02
286.5745239	0.19
287.8614502	20.61
296.9324951	0.21
299.2113342	0.10
301.2537231	0.22
302.2128601	0.64
303.0900269	0.64
307.6836243	0.45
310.7335815	1.34
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	422.1059
Annotation	Taveuniamide A
Peak:m/z	Relative Intensity
119.9775620	0.20
127.8751678	0.57
135.8393555	0.09
141.9710693	0.17
142.8768463	0.10
155.0528564	0.66
179.1174011	0.17
188.9945984	0.05
192.3322906	0.08
194.1343384	0.96
195.1847687	0.16
197.2056427	0.17
197.8743591	0.27
198.9888916	0.37
203.1195068	0.97
210.0022888	0.17
211.1848755	0.28
217.1387024	0.10
220.0625916	0.15
222.1966553	0.56
224.2247620	0.10
224.9114685	0.14
227.2300415	0.16
229.0327606	1.55
233.0883789	0.10
235.1499939	0.20
238.1390686	4.88
241.1095581	0.37
242.0372925	16.71
242.9775391	0.40
252.0690002	0.07
253.0476990	0.14
256.8773193	0.09
264.0457458	0.64
265.8868408	0.56
268.0353699	0.35
270.1752014	0.09
272.1992798	16.07
277.2002258	0.13
284.1066589	0.71
286.1354675	6.24
288.2308350	3.93
293.1267090	0.36
296.2241821	0.52
298.1005859	2.54
299.2220459	0.17
302.1951904	0.27
306.5150757	0.05
312.1175537	6.08
313.2480469	1.29
314.1680603	1.83
316.0267334	1.55
320.2044983	40.05
330.1748657	0.28
332.1678467	11.83
333.2653503	0.54
339.9789429	1.22
341.1554260	0.36
342.3567505	0.37
346.1215820	8.95
347.4441528	0.09
348.0986023	1.72
349.9492188	0.08
358.1799927	6.20
364.1628723	100.00
376.2354126	0.09
378.2727356	0.22
381.0580139	71.87
381.6721497	0.24
385.3477478	0.22
404.1517334	3.93
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	452.2782
Annotation	16:0 LYSO-PE
Peak:m/z	Relative Intensity
139.8391113	0.02
153.0264435	0.05
196.0239258	2.12
196.9220734	0.28
214.1008911	1.19
214.8856812	0.06
237.4694824	0.06
252.7625427	0.08
255.2379761	100.00
256.3543701	32.72
267.5808105	0.03
336.3721313	0.17
341.3095703	0.05
346.0438843	0.06
348.1417542	0.13
359.1954346	0.13
363.4207764	0.12
365.2501831	0.10
378.990509	0.11
381.8551941	0.08
391.4334412	1.29
392.7860718	0.07
395.3098755	0.09
407.3459778	10.47
409.2948914	0.23
410.8836975	0.07
412.1463318	0.15
417.1940918	0.18
421.4839478	0.06
423.9757385	0.15
431.2835999	0.08
435.1001892	0.99
436.0884094	0.11
444.5409546	0.15
453.0498657	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	240.1225
Annotation	Unknow
Peak:m/z	Relative Intensity
83.0532684	0.05
98.1574860	0.10
109.1568298	0.03
124.0449066	0.08
126.0083313	0.32
133.3205872	0.01
136.0102539	0.02
144.9450684	0.02
151.9906616	0.20
158.1576080	0.05
164.0706329	0.02
166.1040649	0.69
176.1569977	0.02
178.0397491	1.52
178.9976959	0.04
181.9239655	0.08
184.1415100	0.03
187.2079010	0.03
189.0779877	0.05
194.1501617	0.96
195.0383606	0.13
196.0720367	0.03
198.9352875	0.08
204.3056183	0.03
205.6371155	0.04
207.0793610	0.06
209.0712280	0.30
210.0514526	0.02
212.0599670	0.19
217.0604401	0.01
222.0513306	100.00
223.0803070	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	419.19
Annotation	2-[4-(3-Hydroxypropyl)-2-methoxyphenoxy]-1,3-propanediol 1-glucoside
Peak:m/z	Relative Intensity
126.8639221	0.11
134.0425110	0.09
137.0490112	0.05
145.0796814	0.07
149.1749420	0.11
152.1409760	0.22
157.1149597	0.14
159.2206726	0.19
178.1566925	0.20
187.1674805	0.16
199.1653595	0.08
199.9202881	0.11
214.8569641	0.30
227.3155518	0.17
237.0485535	0.11
239.1983337	0.11
248.2409973	0.08
257.1458435	100.00
257.7930908	0.50
260.1609802	0.38
274.7142334	0.32
278.1914062	0.20
286.9767761	0.17
290.1862793	0.17
292.8858032	0.09
298.9221802	0.62
306.0608521	0.14
313.3491821	0.20
319.0451050	0.11
322.2905884	0.26
329.0170288	0.27
330.4342041	0.17
331.5856934	0.11
337.4814453	0.74
346.4944458	0.05
355.4281006	0.14
357.5027466	0.84
364.1512146	0.20
373.6414185	0.88
375.9624023	0.43
382.6377563	0.35
383.5332642	0.07
384.7136230	0.11
390.1730042	0.31
391.1541748	0.31
399.0633545	0.11
400.9884949	1.49
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	332.1332
Annotation	Ciprofloxacin
Peak:m/z	Relative Intensity
105.9829559	0.06
108.0074615	1.69
109.2631302	0.04
122.9844894	0.02
123.9654236	0.11
133.1222534	0.11
134.0438232	0.44
134.9529877	0.03
135.9876251	1.00
138.1921387	0.03
149.9075317	0.03
152.0236053	5.39
154.1483307	0.24
164.2770386	0.01
170.05896	8.24
175.2566223	0.02
182.0695953	0.03
202.1527405	0.04
232.1100464	0.07
235.131897	0.03
236.9994507	0.02
242.0094299	0.23
243.1445007	0.01
250.4459839	0.01
251.2591858	0.04
254.9984436	0.01
266.2601318	0.02
272.1507874	0.02
278.0169373	0.13
286.2797546	0.02
288.2316589	0.10
291.3855591	0.05
296.2144165	0.11
314.1403809	100.00
315.0936279	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	539.14
Annotation	Unknow
Peak:m/z	Relative Intensity
143.0745544	0.02
160.8793488	0.22
179.0453949	0.98
221.0331573	0.52
250.2383881	0.19
250.9273987	0.74
257.1681519	0.02
281.1236572	0.27
321.4218140	0.02
323.2352905	0.52
341.1359253	1.74
359.1220093	0.16
377.2427979	6.28
384.4310913	0.06
412.5172729	0.05
503.2618408	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	540.1327
Annotation	Unknow
Peak:m/z	Relative Intensity
162.9022675	0.04
167.0036621	0.17
170.0024109	0.06
175.2315063	0.11
177.0661621	0.11
179.0779114	0.89
185.0440979	0.15
194.8236237	0.07
197.1570129	0.29
200.0096130	0.21
210.2025909	0.23
226.2924500	0.04
230.3137512	0.11
233.6490784	0.02
236.3715515	0.08
240.1204071	0.21
242.0092163	0.03
249.1528320	0.13
252.0643005	0.04
254.0988464	3.54
255.1145477	0.08
256.3353271	0.05
262.2168579	0.08
266.4312744	0.06
272.1353760	14.85
274.4199219	0.10
280.1559448	0.02
286.1473694	0.48
288.0781860	2.31
290.1243286	0.94
294.0841675	0.06
298.0585327	0.05
301.1204529	0.03
303.6007690	0.18
304.2246094	1.49
306.1864014	5.97
308.3508301	0.25
312.3327637	0.71
314.1038208	0.07
315.4434814	0.11
316.2885132	0.07
317.2189331	0.09
318.1778564	0.17
324.1927490	1.07
326.0533447	0.30
330.3026733	0.04
331.3911133	0.08
332.2192383	0.24
333.4615479	0.03
336.9905396	2.21
338.0882568	0.18
342.1566162	0.64
344.1025391	1.30
346.1685181	0.09
352.4190674	0.03
354.2763672	0.79
356.3292236	0.13
358.1389771	2.28
360.1813354	2.92
372.3935547	0.55
374.3506470	0.41
376.2129517	1.09
378.1612549	100.00
380.0921631	0.02
386.2066040	0.37
388.1126099	0.76
388.7531738	0.11
390.1721802	0.82
394.6315918	0.12
395.2847900	0.02
398.2648315	0.33
399.4851685	0.03
401.1063232	0.02
402.1183472	0.18
404.1491089	0.49
406.3616943	0.34
407.2030640	0.11
408.3984985	0.06
409.1798096	0.27
410.8003540	0.11
416.1921997	1.88
419.9473877	1.87
420.5667725	0.18
424.1887207	0.18
429.4714966	0.37
430.2003174	3.58
431.0987549	0.05
432.2850342	1.56
434.2608032	5.01
437.1219482	0.05
438.3918457	0.03
444.2629395	0.17
447.2910156	0.85
448.1723022	6.74
450.2057495	27.72
455.2745361	1.04
460.2017822	0.38
462.3154907	0.32
463.3032837	0.05
465.2645874	0.10
466.2846680	1.32
468.2119751	1.12
473.9618530	0.53
474.6174316	0.03
476.0241089	0.42
478.1694946	1.19
480.0957642	2.77
481.0501709	0.02
482.0481567	0.02
491.2913208	0.10
492.2210083	0.54
493.0280151	0.10
493.9851685	0.23
495.6623535	0.37
496.4965820	0.35
499.1380615	2.20
503.4425049	0.11
504.0813599	0.07
521.5282593	0.73
522.2279663	7.29
523.0100708	0.01
523.9266968	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	429.1248
Annotation	Unknow
Peak:m/z	Relative Intensity
130.8737183	0.05
161.0729675	0.14
176.0702820	0.10
177.1350861	0.08
179.0876465	0.03
191.2685242	0.14
197.7865906	0.18
213.8590088	0.20
235.1710815	0.05
252.8800049	2.50
255.0870667	0.15
266.6581116	0.04
282.0568848	0.07
292.1123352	0.09
325.3477173	0.05
334.3695068	0.06
341.1554565	100.00
342.1246948	0.30
352.5850525	0.15
383.1694946	1.16
410.9825134	0.37
412.1866150	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	282.0842
Annotation	Crotonoside
Peak:m/z	Relative Intensity
106.9916306	0.38
107.6757965	0.04
132.9905701	3.91
149.9777527	100.00
150.7720184	0.09
156.0906982	0.03
166.1145020	0.03
176.0221252	0.16
191.9928894	0.06
193.2575989	0.03
206.1788330	0.03
222.1419983	0.02
236.1239929	0.03
238.2240601	0.11
263.5780640	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	279.0003
Annotation	Unknow
Peak:m/z	Relative Intensity
96.7718887	0.04
98.9317474	0.19
111.0931473	0.03
112.9051971	0.06
113.6920319	0.03
114.9564056	0.13
135.0405273	0.29
143.0183411	3.38
150.9487305	1.22
156.9139252	0.08
166.9913635	0.05
168.9146423	0.48
172.9114075	32.85
173.9509277	100.00
175.0531311	5.68
178.9346313	0.03
184.9594421	0.02
200.9367676	0.56
206.8566284	0.05
213.1440125	0.11
215.0638733	0.71
217.0378723	0.08
218.9162292	0.09
231.1876526	0.07
232.9730225	0.04
234.3927307	0.02
235.3791809	0.19
244.9917603	3.09
250.9779358	0.05
260.3624573	0.55
261.0135498	0.06
261.8815613	0.09
263.3799744	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	447.2005
Annotation	Cornutin F
Peak:m/z	Relative Intensity
129.0830994	0.05
130.0902405	0.02
157.0854797	0.18
158.1970062	0.07
166.0473480	0.26
175.0394440	12.67
185.1838684	0.01
186.1519165	0.07
192.8646240	0.03
199.1556702	0.05
209.2034607	0.09
210.2714233	0.02
217.1362000	0.12
223.3670044	0.05
227.1837616	0.37
240.3204956	0.04
241.1124878	0.07
241.9594116	0.07
244.2352295	0.13
245.3731995	0.05
251.9768982	0.03
254.7359619	0.05
256.0477600	0.02
258.3033447	0.04
259.2504883	0.05
263.1390381	0.07
267.9779358	0.37
268.9913940	0.04
273.3665161	0.09
276.2930908	0.21
283.2730713	0.28
284.4081726	0.02
286.3654480	0.39
300.2197266	0.82
301.2796631	0.87
302.5122681	0.06
303.3859863	0.08
313.2756348	0.05
315.1295776	0.03
316.4312439	0.07
318.1945801	100.00
321.3267212	0.04
322.1918945	0.07
327.0284729	0.02
328.1469727	0.02
337.1851196	0.09
338.4042053	0.03
342.1358032	0.01
345.4709473	0.04
355.2741394	1.94
356.3981323	0.43
357.1203613	0.16
360.2409058	0.07
372.1677856	0.07
373.0881348	0.12
384.2456970	0.03
386.0771790	0.14
387.3283386	0.28
389.8847351	0.10
394.1473083	0.02
402.5968933	0.64
403.1985168	0.99
405.3177185	0.33
411.2322693	0.20
412.3783875	0.05
429.2890320	16.24
430.4099426	1.73
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0854
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
81.00360107	0.75
82.85671997	1.39
94.85897064	2.33
96.93006134	1.04
98.73936462	0.30
105.1263885	0.29
108.964386	1.37
112.9051514	0.91
115.0460052	1.36
118.9023895	1.11
121.0842896	2.47
123.1761017	1.34
125.0238495	1.04
126.9963989	0.39
128.9738464	16.48
130.8300476	0.48
134.9519043	2.19
139.1994476	0.90
141.2706757	1.39
142.9281769	1.79
144.7080231	1.23
146.8918457	1.19
150.9548492	90.63
152.0218506	8.19
153.0009003	1.91
153.9051971	1.22
155.2328339	0.87
156.1357269	0.67
157.0384979	0.87
159.1486511	6.26
161.0518494	0.76
162.8426056	4.02
164.9194489	3.97
166.073288	1.60
167.1072998	6.45
169.0339508	4.34
172.9281158	0.76
174.7733917	0.41
176.995285	0.91
177.7289581	1.41
178.9314117	3.94
180.3079987	0.52
181.1559601	4.05
182.1608124	0.97
183.0603943	0.50
185.1335297	5.49
191.0817719	0.48
193.2277374	1.62
194.813736	0.24
195.4669952	0.30
197.2047577	9.32
199.0735168	3.91
206.0348969	1.24
207.0591431	2.60
208.3804169	0.30
209.1632538	1.69
211.0738068	3.80
213.1947174	0.52
217.1933594	6.62
225.1598206	12.97
226.1917877	1.97
231.835495	0.62
235.1724091	24.15
238.1603546	22.92
239.0848389	2.90
253.0887909	100.00
254.2446747	5.41
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	464.1156
Annotation	Unknow
Peak:m/z	Relative Intensity
145.3928070	0.04
173.0086823	0.03
179.0575256	0.09
182.1746521	0.04
186.1894989	0.03
202.4639130	0.02
204.7922363	0.09
227.2127533	0.03
229.2919312	0.04
240.7100525	0.02
255.0906677	0.04
261.3296204	0.05
266.2063293	0.05
271.3854370	0.02
282.3589783	0.02
286.8040771	0.02
296.2530518	0.04
296.9514160	0.11
298.1063538	0.04
299.0518799	0.02
302.2099609	0.02
309.5392456	0.05
311.0177612	0.03
313.5700073	0.08
314.2829590	1.31
315.2894897	0.11
335.1730957	0.01
336.9656982	0.04
340.5291138	0.03
345.2011719	0.06
346.0851746	0.05
347.3026733	0.06
348.4238586	0.09
358.0208740	0.02
358.9679260	0.15
361.0502930	0.44
363.9155884	0.01
373.4234314	0.01
374.0644226	0.05
376.0406799	0.01
377.0838928	0.04
379.1686096	2.79
381.8063965	0.04
382.5940857	0.03
392.3491516	0.07
398.2925720	0.02
401.1871338	0.01
402.3110046	0.08
404.1807556	0.01
405.0629272	0.48
410.9567261	0.03
420.1761780	100.00
423.1039124	0.01
428.1792603	0.11
429.0827332	0.02
432.4443054	0.10
435.5904236	0.03
444.2335815	0.01
445.5866394	0.32
446.4413452	0.09
447.1598206	0.10
454.2926941	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	357.0129
Annotation	Unknow
Peak:m/z	Relative Intensity
101.0643845	0.19
102.9110794	1.35
103.8930969	0.62
104.9123077	1.29
106.6154633	0.10
108.8985443	0.06
110.9099197	1.90
111.8338394	0.58
112.9074326	6.24
114.2367477	0.97
114.9006042	3.50
116.8582001	0.69
118.9873734	2.47
120.9634399	0.03
122.9233093	0.39
124.9547501	0.41
126.9549789	0.84
128.9709778	32.24
130.2557373	1.39
131.0257416	5.13
132.9711914	0.38
135.0283508	0.20
136.8397217	100.00
138.0668640	0.11
138.9127045	1.30
140.8010559	0.20
142.7953796	1.45
144.0339050	0.30
144.9367676	4.64
146.0845795	0.37
146.9515076	1.16
151.0296631	0.27
152.0486450	0.29
153.0184326	1.28
155.0958710	0.38
158.9901886	1.15
160.9181824	7.18
161.6480103	0.17
162.8404541	1.40
165.0538635	2.26
167.2315979	0.10
168.9542847	3.71
169.6736755	0.04
171.0398254	4.91
174.9487152	5.35
176.4930420	0.76
177.1062164	1.07
178.8778076	0.43
182.8742371	0.58
184.1583862	0.59
184.9260864	0.46
186.0178528	0.45
187.0641479	1.11
192.9076233	5.84
194.9172058	4.98
200.9355011	1.83
202.2355499	0.22
203.0463257	1.24
206.8616333	0.37
209.0991364	0.14
210.3570251	0.56
211.0133362	1.14
214.7742004	0.26
216.9794922	0.29
218.8513184	0.24
224.7996826	0.32
226.8567505	0.80
230.3879395	0.15
233.0939636	0.37
234.9585876	1.92
239.1958923	0.28
242.3533936	0.25
245.2724304	0.22
249.0620117	2.98
250.8289185	10.16
252.0911865	0.12
267.0051880	26.72
280.5198975	0.04
281.9714966	0.04
283.1478882	0.37
293.1473999	0.07
311.4286804	0.23
312.2214966	2.02
313.1664429	0.23
320.0831299	0.09
338.2984009	1.37
339.1890259	2.33
363.4582825	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.0712
Annotation	7-Hydroxy-3-Methylflavone
Peak:m/z	Relative Intensity
105.0149231	0.70
113.2559509	0.16
117.1612091	0.29
122.0310059	0.78
147.0950775	0.46
148.9365997	1.19
149.8552704	0.28
160.842041	0.22
167.9724579	0.58
178.9155121	0.76
179.8488922	4.26
181.0849762	2.48
183.2651978	1.43
191.8526154	1.00
194.1693878	0.28
194.9089813	0.60
196.0374603	0.40
207.0664825	8.14
208.0369415	8.97
209.151001	10.24
210.2225189	0.62
222.1329346	6.62
223.1593475	20.12
224.2137909	12.81
225.3143768	0.62
233.0348969	0.64
251.0747223	83.19
252.1268921	100.00
253.0960541	3.42
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1025.3
Annotation	Unknow
Peak:m/z	Relative Intensity
341.0014038	0.16
503.3369751	0.39
664.6305542	0.16
707.5790405	0.29
766.5744019	0.02
827.3272705	0.08
863.6583252	0.31
869.3709717	0.20
971.3444824	0.04
989.3359375	100.00
990.0109863	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	404.96
Annotation	Unknow
Peak:m/z	Relative Intensity
112.9946136	0.18
114.9404144	35.01
118.7111816	0.32
126.5537186	0.27
129.0177155	2.66
130.9718628	100.00
133.1952209	0.08
134.8219604	0.52
135.9879456	0.10
136.7866211	3.93
138.7370300	0.22
143.0624237	0.83
145.0029907	6.27
146.9450836	13.77
149.0201721	0.06
151.0201721	0.11
151.9121704	0.22
152.9078064	0.81
154.9596100	1.42
156.0705414	0.19
157.0217896	0.65
160.9082794	0.76
162.9105225	2.40
165.3230286	0.29
166.9833221	0.22
168.8751221	1.65
171.1806946	0.20
172.7993469	0.32
174.7788086	1.01
175.9372253	2.22
176.9217224	29.46
178.2171326	0.55
179.0497742	1.97
181.1295776	0.15
185.0077209	0.56
187.0920258	0.09
192.8050537	0.69
193.4756012	0.78
194.9679718	10.43
200.8333130	1.86
206.9132538	2.31
208.1304474	0.33
209.0185394	1.42
210.2262573	1.65
210.9731750	2.56
212.5704193	0.21
217.0758362	0.52
218.9107513	3.89
226.8005676	18.04
228.9642639	0.22
231.0617981	0.12
235.4328918	0.24
241.0686035	0.32
248.0209351	0.23
249.1590576	0.68
250.1405029	1.27
250.9458313	14.99
257.1344910	0.31
258.9117126	3.69
266.0561523	0.46
269.5059814	0.64
272.8980713	0.22
273.7857361	0.76
277.4136353	0.38
280.8686218	1.43
282.4806213	0.19
288.7536621	0.75
291.3209839	0.20
295.3622437	0.67
296.9272766	0.20
298.8859253	43.76
299.5006714	0.09
301.1819458	0.22
309.1849670	0.29
311.9396973	0.19
327.2984009	0.57
328.7316284	3.11
329.8802795	11.23
330.7158508	1.64
332.8111267	0.19
337.4384766	0.30
344.0704041	0.59
354.7647400	1.20
355.4591370	2.57
358.3952942	0.24
360.2814026	0.50
362.4819031	0.71
363.1103821	3.70
369.6423645	0.35
371.5604858	0.62
373.2281799	1.63
386.1522827	0.92
387.1219788	2.53
390.6263733	0.19
403.3104248	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	407.1726
Annotation	Ethotoin
Peak:m/z	Relative Intensity
115.9538193	0.24
141.9544525	0.33
143.9272156	0.09
154.0068665	0.08
159.1451721	2.00
172.9474182	0.25
186.2202911	0.35
203.0580902	100.00
250.2758789	0.11
305.2235718	0.05
347.2048950	0.05
362.5200500	0.05
365.1572266	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	520.2678
Annotation	PS(18:2(9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
151.1610107	0.19
152.9603577	6.84
171.0974579	0.80
195.2239380	0.14
202.0892639	0.23
204.9953003	0.07
211.3424377	0.14
214.0570068	0.23
232.9058685	0.09
239.9382324	0.53
254.0423584	0.19
258.2901611	0.20
265.1918945	0.24
267.7006226	0.07
285.9604492	0.31
295.4760132	0.13
296.3327942	0.23
314.8253784	0.27
317.9324341	0.09
322.1244507	0.03
334.1470337	0.12
335.6315308	0.05
357.9205322	0.04
369.8062134	0.06
412.2518311	0.32
413.0202026	0.04
433.2753906	100.00
434.0020142	0.05
446.3769531	0.10
448.5293579	0.08
451.4359131	0.05
452.2879639	0.09
458.2693481	0.19
462.1236572	0.10
463.8325195	0.24
474.2758179	2.05
476.5842285	0.13
477.9407349	0.08
479.0945435	0.36
482.5801392	0.35
483.3580322	0.46
484.3761597	0.43
485.0324097	0.26
495.4727173	0.34
498.6187744	0.30
501.7251587	0.39
502.6709595	0.38
503.3519897	0.57
516.1533203	0.09
520.2340698	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	421.165
Annotation	Ugonin P
Peak:m/z	Relative Intensity
136.9760590	0.13
143.2080688	0.12
147.1911621	0.22
157.1709137	0.12
178.8945160	0.08
187.2600708	0.06
189.2364349	0.09
200.1955109	0.13
203.8151703	0.06
217.0454712	0.50
226.2759094	0.06
228.9062042	0.09
255.4243164	0.28
259.2093506	0.42
273.0848083	0.13
277.1241760	100.00
278.1487427	0.08
282.1801453	0.35
287.1478271	0.06
291.2323914	0.13
292.2581482	0.22
300.9888916	0.33
318.7521362	0.34
319.3527222	1.49
325.2139282	0.12
329.2109375	0.10
331.0372314	0.13
333.3286133	0.86
335.2187195	0.11
337.0770264	0.27
342.3324890	0.12
344.3757935	0.10
345.3080444	0.29
347.2438965	0.08
351.3363037	0.10
356.2412720	0.53
357.1485596	0.38
358.9361267	0.68
360.4212646	0.06
361.1689148	0.77
362.4140015	0.25
367.2936096	0.29
373.0795593	0.29
375.2618103	0.70
377.3158264	2.39
379.0100098	0.20
379.8153381	0.09
384.0426941	0.11
385.2305603	0.26
401.3122559	0.15
402.3047791	0.13
403.1486511	1.04
405.2129517	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	280.2632
Annotation	linoleamide
Peak:m/z	Relative Intensity
80.96183777	0.37
86.19944763	0.17
91.09157562	0.11
92.95870209	0.12
94.93690491	1.02
96.99448395	0.21
99.95709991	0.70
104.9227905	0.24
106.9966736	0.34
108.9893951	1.06
111.0397263	0.49
112.8215637	0.09
114.0317612	1.72
116.1401825	0.07
118.9745026	0.22
121.0744934	0.75
123.0508347	1.94
125.0445251	0.66
126.0612335	0.22
126.9015121	0.17
128.0031738	1.55
129.1381531	0.12
132.9099731	0.32
135.0653687	1.86
136.0180664	0.03
137.0108337	1.71
139.1144409	0.94
139.9888916	0.21
141.2586975	0.29
142.1656799	1.58
145.1850586	0.09
147.0704346	1.62
149.1023712	2.14
149.8403931	0.06
151.0085144	2.59
152.9821625	1.04
154.00737	0.59
155.2329102	0.16
156.1387329	2.42
161.1325989	1.54
163.1659241	1.86
164.9818268	2.81
165.8319702	0.21
167.2310028	1.39
168.2030029	1.00
170.1386414	2.78
171.9286804	0.28
173.1790771	0.21
175.1299133	2.36
177.3188782	0.94
179.0559998	3.20
180.3594055	0.07
181.2318573	0.45
181.9808655	1.02
183.5669403	0.22
184.1998596	2.69
188.3653564	0.45
189.1157074	2.01
191.1844788	0.19
193.0625458	0.92
194.1055908	0.04
194.8286133	0.06
196.1662903	1.11
198.1985168	1.92
203.2648315	0.80
205.2506104	0.22
206.1045227	0.22
207.2047119	0.44
210.1785889	2.32
212.2288513	0.08
217.1243591	0.73
219.1295471	0.15
221.1918945	1.98
224.1098022	2.37
234.0332031	0.21
234.994873	0.20
237.3356323	0.08
238.3286743	0.44
245.2257996	45.80
245.835144	0.07
249.0499268	3.81
252.5445251	0.15
263.2443237	100.00
265.0090332	0.75
279.4824829	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1020.2833
Annotation	Unknow
Peak:m/z	Relative Intensity
363.1464539	3.36
525.3012695	5.51
526.3179932	1.75
543.3487549	2.66
687.3427734	12.57
688.4796753	1.23
705.2837524	6.72
706.3123169	0.93
849.3354492	8.53
850.3389893	4.01
851.0291748	0.22
858.5506592	4.32
859.2617188	0.18
867.4252930	14.69
868.3956299	0.24
869.7501221	0.27
930.3629150	2.62
931.0639648	0.89
939.5957031	100.00
940.3620605	2.52
941.1075439	1.25
942.7037354	0.24
945.5876465	0.28
947.2213135	1.48
1011.4091800	6.20
1012.0205080	0.16
1012.6252440	2.35
1029.1422120	0.58
1173.3536380	9.16
1174.5043950	2.89
1191.3966060	8.18
1192.1735840	1.93
1193.2857670	0.56
1335.5579830	4.94
1336.4525150	3.75
1352.3475340	0.70
1353.4273680	17.45
1354.5599370	8.40
1355.5479740	0.32
1497.6600340	6.54
1498.4771730	1.66
1515.6163330	11.47
1516.5841060	5.35
1517.5943600	0.29
1659.7976070	0.77
1660.7995610	1.56
1661.7393800	1.01
1677.5098880	15.38
1678.5740970	11.33
1679.6999510	1.51
1822.6314700	0.43
1839.5057370	30.25
1840.5968020	18.03
1841.7086180	2.46
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	623.2191
Annotation	Unknow
Peak:m/z	Relative Intensity
280.1743469	0.04
281.1583862	0.19
293.1063232	0.10
299.0667725	0.05
305.9667053	0.06
315.2649536	0.07
317.9524536	0.06
335.1766357	0.12
336.0792847	0.06
338.3118286	0.15
354.1979370	0.11
373.0070801	0.05
395.3919678	0.13
423.8419800	0.13
432.3829956	0.05
436.3909912	0.15
443.5177002	0.09
447.1107178	0.15
457.2586670	0.21
461.1164551	0.30
476.0678101	0.12
481.3632202	0.08
489.3398438	0.07
490.2186279	0.13
491.1315308	0.12
493.6950073	0.09
497.6082764	0.11
498.4240112	0.06
507.1789551	0.52
516.7804565	0.06
517.6618042	0.09
521.3971558	0.03
532.3564453	0.16
535.0326538	0.03
564.2731934	0.13
565.6253662	0.10
577.3007812	100.00
577.9295654	0.32
579.2294312	0.25
581.5138550	0.29
582.2037354	0.37
599.6551514	0.16
604.4794312	0.27
605.2219849	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	345.1189
Annotation	3,4,5-Trimethoxyphenyl glucoside
Peak:m/z	Relative Intensity
128.1192932	0.06
149.0857239	0.13
153.7158203	0.12
161.8135071	0.04
165.2598419	0.15
167.7900391	0.13
179.0034332	0.08
182.9414673	0.11
184.1114349	0.03
196.9278564	0.03
213.8725586	0.03
215.1404419	0.04
216.1083679	0.29
219.3969727	0.04
221.1817322	0.09
227.0774841	0.02
231.5288696	0.07
243.1972046	0.12
249.3013916	0.34
257.1689148	0.69
258.0543213	1.27
258.8692627	0.05
261.2840271	0.05
270.9315491	0.09
273.2643433	0.17
283.1120605	0.09
287.0348816	0.08
289.1769409	1.28
299.1287231	100.00
300.3101501	0.04
301.1043396	0.39
301.9715576	0.11
304.0802917	0.11
309.1901550	0.12
325.0180054	0.34
327.2902222	0.38
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	261.15
Annotation	Cordiaquinol J
Peak:m/z	Relative Intensity
74.95935059	0.04
109.0924225	0.11
119.0867157	0.03
143.1659088	0.08
158.9622498	0.12
169.1407623	0.07
172.8291779	0.08
186.827179	0.06
190.259964	0.07
191.1392059	0.13
199.039093	0.05
200.9503937	0.24
202.7756958	0.05
206.3607025	0.11
214.8941803	0.33
217.3574219	0.16
218.0583496	0.03
219.1446381	0.09
227.2526245	0.22
228.8826752	0.05
241.243515	0.03
243.1368256	100.00
244.0204926	0.51
245.1702423	3.14
262.1473083	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	224.1041
Annotation	Cornutin F
Peak:m/z	Relative Intensity
72.9503632	0.17
75.5501862	0.06
83.8990707	5.88
112.1032715	0.18
115.9819946	0.52
121.0984497	0.09
124.1127777	0.33
129.9109344	50.79
131.0727386	0.52
133.7541199	0.03
141.7532501	0.37
150.9872284	5.36
155.9923553	0.11
157.0272369	0.10
159.5863495	27.68
163.8011932	0.20
164.5453644	0.33
166.1031799	0.30
170.0780792	17.59
171.0372009	0.76
172.5628052	2.51
173.4735413	0.27
175.1107025	5.04
176.2347870	0.15
177.5419617	0.17
178.1747742	0.40
180.0184937	0.55
182.0064850	0.79
182.9709320	2.02
186.5157928	0.25
192.5752106	26.87
193.4554291	0.30
195.6270142	7.30
196.4582977	0.18
201.1051178	10.51
201.8533478	0.40
202.4954376	0.20
206.0673981	0.53
207.0593414	2.40
209.9412842	2.07
210.8798370	0.16
215.5167694	100.00
216.1250763	5.07
218.3436127	0.04
229.1488800	0.77
243.2577972	0.07
245.1823273	0.22
251.2808838	0.54
261.1710815	0.57
268.2032471	0.06
273.0027771	0.97
278.1473389	29.84
279.1179199	1.85
284.4142456	0.13
286.2728271	0.16
288.1973877	0.11
291.0448608	0.48
301.3230286	1.08
302.1564331	0.05
318.2015991	94.67
319.1850891	1.73
344.1600647	0.35
356.1182556	1.90
384.4601746	0.07
390.2999268	2.02
390.9769897	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	309.12
Annotation	Unknow
Peak:m/z	Relative Intensity
95.0453110	0.05
96.9504471	0.99
98.9050522	0.15
100.9110718	0.14
102.8369598	0.21
108.9268112	0.21
111.1435394	0.11
115.9300613	0.58
116.9586258	0.72
126.8899536	4.09
128.9057922	21.12
130.0983276	1.27
131.7222595	0.09
135.3742065	0.17
139.9487305	0.26
143.9317932	0.10
144.9813538	2.07
146.8058777	19.16
148.0590820	0.13
149.1369324	0.17
156.1092224	0.14
158.0419006	0.12
158.8558044	0.15
162.1670837	0.76
162.8604279	1.04
164.7932434	12.36
170.4543457	1.68
172.7532959	0.04
174.9721680	0.18
178.0510559	0.75
178.9099884	0.66
180.0956421	8.16
187.0897217	0.12
189.0459442	0.74
191.2123413	0.14
197.2242279	0.11
199.0058289	0.11
201.2810364	0.07
203.2120972	0.21
206.0808716	0.46
206.9882202	0.09
210.9031677	0.73
212.2015686	0.33
212.9657898	0.20
217.0843506	100.00
218.0315552	8.93
219.1061707	21.07
224.3103943	0.04
225.0012207	1.99
226.6100159	0.05
230.4924927	0.16
231.3084106	0.49
233.4372559	0.20
236.0796814	0.54
237.0130310	0.80
242.9543457	4.46
244.9177246	0.11
250.9739380	1.86
252.4699707	0.49
253.9757690	5.14
254.9400024	15.95
263.1730347	0.56
266.1766052	0.17
267.2456055	0.65
268.1547241	0.88
271.0285034	0.19
272.2730408	3.17
272.9953918	14.90
277.1756592	0.66
277.9780273	1.47
280.2186279	0.40
281.1603699	0.31
290.4440308	1.65
291.1468811	3.94
292.0410156	0.66
299.3155823	0.15
300.0486450	0.43
300.7670898	0.24
303.5155029	0.49
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	220.1174
Annotation	Pantothenic acid
Peak:m/z	Relative Intensity
69.1312790	0.12
71.8056335	1.98
72.9678879	0.05
73.7857742	0.04
80.7591858	0.10
87.0126648	0.06
89.9790497	31.07
94.9245911	0.07
97.9154663	0.28
99.6287384	0.03
112.9924316	0.16
115.9916840	3.73
118.0600739	0.10
119.1270447	0.02
130.0041504	0.14
130.9005737	0.57
136.2312469	0.06
142.0406494	0.21
143.9432831	0.02
145.9938049	0.25
147.8739624	0.11
156.0156403	0.34
158.3491974	0.07
159.1104279	0.07
159.9825897	0.24
166.0673676	1.07
172.0838928	0.12
173.1482086	0.24
174.1560822	4.25
178.0789948	0.03
184.0068054	24.45
184.8770905	0.08
199.5330048	0.19
202.0355835	100.00
203.1056213	0.15
210.4435577	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	502.2495
Annotation	Unknow
Peak:m/z	Relative Intensity
143.9044647	0.12
148.3004456	0.18
162.1060944	0.37
173.0090790	100.00
177.0002747	0.09
177.9850159	0.56
179.0810547	2.81
185.1987305	0.14
189.0818329	0.11
192.3496857	0.05
193.8597412	0.35
195.1661987	0.99
210.9762421	0.31
212.0456238	0.06
213.1035004	0.07
217.0905457	0.22
226.1186371	0.34
231.0089417	0.16
233.0093689	0.09
239.1423645	0.13
242.8388824	0.28
260.4254456	0.12
265.8497009	0.24
270.3083801	0.25
275.1442566	0.71
284.4164429	1.37
285.1352539	0.42
286.1827393	10.48
301.9699097	0.29
308.2283020	10.64
312.4984131	0.06
314.1974182	0.11
314.9164734	0.20
323.9255981	0.21
330.1571655	20.90
336.0768127	0.27
339.3686523	0.34
340.1064148	0.23
353.2951660	0.09
363.1510010	0.22
368.3726501	0.34
370.5454712	0.36
371.4168701	0.18
372.9347229	1.67
381.4907227	0.27
382.3481445	0.09
386.2319336	1.47
387.2482605	0.57
402.5762024	0.27
409.1050720	1.96
410.3615417	0.08
412.4041443	0.59
427.2548523	5.39
428.1780090	0.06
432.3292847	0.23
456.5537415	0.42
457.2472229	0.75
460.8090210	0.12
466.1714783	0.22
470.5006409	0.17
484.2621765	15.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	434.1834
Annotation	Naamidine D
Peak:m/z	Relative Intensity
123.0068130	0.17
132.2860870	0.21
134.9274902	30.32
135.9894562	0.82
137.8916016	0.57
146.9749908	0.60
165.0557861	2.55
175.1979218	0.07
182.1025696	14.04
196.9160461	0.06
237.2204895	0.13
243.0356445	0.47
259.2865601	0.09
263.0630188	1.67
263.8437805	0.44
272.0337830	3.17
292.3207397	0.38
296.9369507	100.00
297.6754761	0.18
303.2143555	0.16
321.0224915	0.15
329.8621826	0.16
343.3621826	0.26
344.4299316	2.52
353.2303772	16.06
360.3420105	0.17
390.9543152	0.18
416.4925537	0.31
424.1820679	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	311.123
Annotation	Tyrosyl-Glutamate
Peak:m/z	Relative Intensity
95.0050583	0.10
116.9325485	0.02
119.0111618	0.24
122.9042053	0.63
123.8240662	0.12
129.9132080	0.19
133.8470154	0.06
136.0694580	5.44
146.9892273	1.43
148.1057739	0.37
148.9004822	0.13
161.9109497	0.05
164.9723206	18.42
178.1808014	0.04
180.0614929	0.02
182.0708923	100.00
190.3803711	0.03
191.1271667	0.13
193.3354797	0.04
195.2787018	0.09
205.0169373	0.02
206.1189270	0.04
213.1997681	0.05
217.3065796	0.04
218.4480896	0.18
219.2543640	0.10
220.5718689	0.04
221.4190369	0.04
223.1229553	0.11
225.2196045	0.04
230.9897461	0.14
233.1692810	0.02
247.1507568	0.07
248.1476440	1.14
252.4157104	0.07
264.1938477	0.03
265.2163696	0.24
266.1948547	0.04
267.2207642	0.09
269.8085938	0.03
275.2462463	0.27
283.4267273	0.13
292.0474243	0.07
293.1080322	2.63
294.1166382	7.52
301.4331665	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	396.1854
Annotation	Unknow
Peak:m/z	Relative Intensity
131.9833374	100.00
133.0180054	0.07
144.8618927	0.06
163.0498962	0.12
164.0642090	0.83
177.0375061	0.28
217.2678223	0.20
226.3653870	0.17
228.8971558	0.41
247.1075439	0.91
249.0975647	1.02
250.1620789	0.28
263.9176636	0.24
265.0993042	0.41
266.0836487	1.06
267.1689148	1.04
269.3526001	0.23
270.2990723	0.32
276.0797119	0.59
277.2518311	0.38
278.1533203	1.09
279.5440674	0.21
292.7243652	0.14
305.2216187	0.14
306.2465210	0.46
321.2334900	0.28
324.4236450	0.29
335.1822510	0.23
338.0567322	0.27
346.3132019	0.12
356.0899353	0.28
360.0037842	1.10
363.1334839	0.08
378.0674133	35.78
379.2375793	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	827.2681
Annotation	Lantanose A
Peak:m/z	Relative Intensity
245.0995636	0.39
246.0337067	0.16
250.8350830	1.36
281.2703552	0.17
305.3255005	0.27
310.9908752	0.08
322.3628235	0.15
323.2554626	0.21
339.1983032	0.07
339.8592834	0.13
341.1122742	12.18
355.2548828	0.29
365.1273193	0.14
381.2584839	0.20
383.1473999	1.37
395.3508301	0.33
401.3507690	0.07
413.0272827	0.26
442.5496826	0.12
449.2879639	0.49
461.3482056	0.20
485.2623291	3.53
503.2749023	29.00
515.3409424	0.27
536.3539429	0.06
545.2346802	100.00
545.8348999	0.29
556.8851929	0.46
569.4242554	0.18
601.4113770	0.27
604.8341675	0.73
634.9097900	0.09
645.4849243	0.24
647.2929077	11.70
665.2548218	19.35
666.2934570	0.61
667.9091187	1.69
668.5703735	0.34
690.6070557	0.21
692.4950562	0.12
707.1964722	0.87
737.3918457	0.46
739.3054199	0.93
792.4777222	0.09
809.7367554	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3alpha,5beta,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
98.95895386	0.38
107.1898575	0.69
109.0910339	1.20
115.1387329	0.32
121.0513992	2.03
123.1046982	1.49
124.9927673	0.18
130.9719849	0.81
132.9676208	0.87
134.9741516	2.34
136.8984528	1.10
138.0848083	0.07
139.1958313	0.09
140.9447327	0.19
143.0482178	1.17
146.9273071	3.53
149.1004639	2.49
151.1575317	1.67
152.6544342	0.43
154.9503174	0.14
156.7236633	0.07
157.3675537	0.25
158.7871094	0.10
161.092041	1.93
163.1725464	0.58
168.9448395	1.18
170.4643097	0.52
173.1136475	1.19
175.0723724	2.04
177.0562134	0.99
179.362442	0.84
183.2305603	0.51
184.1724243	0.12
187.1148682	0.60
189.0615997	1.44
190.8467102	0.59
192.3300934	0.17
197.1067963	0.40
202.8269653	1.11
203.5249481	0.38
204.7440796	0.18
206.6565247	0.17
209.284668	0.39
211.0351257	1.78
215.8930664	0.12
217.0976868	1.85
217.703125	0.26
219.0083923	0.12
222.0653076	0.46
223.1244812	1.17
229.11203	0.09
230.2939148	0.13
231.0332336	1.19
234.9372559	0.41
239.2352295	0.12
241.3569031	0.44
245.2306519	1.21
247.2729492	7.41
248.4281006	0.26
251.7279053	0.33
259.1983032	0.32
263.3773193	0.44
267.2587585	0.20
268.2265625	0.25
269.3581848	0.09
271.3388062	0.28
277.2146606	0.22
279.258728	1.18
281.5068359	0.27
283.2616882	0.20
285.3430176	0.91
287.867157	0.35
288.8043823	0.43
295.3551941	0.80
296.3041382	0.25
297.3029175	0.87
299.3114929	2.20
300.0973511	0.07
305.1804199	3.07
311.9794312	0.24
313.0847778	0.87
323.246521	100.00
323.8487549	0.53
325.4238892	0.41
341.1810303	0.98
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	311.22
Annotation	trans-EKODE-(E)-Ib
Peak:m/z	Relative Intensity
97.02219391	0.47
99.00312042	1.03
102.9357758	0.64
111.644165	1.57
113.0197449	0.26
121.0914154	0.30
123.038002	0.34
127.0652618	0.43
129.1014099	0.76
131.0365906	0.90
135.0788269	1.15
137.2116699	0.39
138.9292755	1.85
140.9173889	1.13
146.9910278	0.77
149.069458	0.64
153.2245483	0.48
154.9784546	1.21
155.9406433	0.95
159.3571777	0.22
161.0474243	0.36
163.0751648	1.08
167.1770325	0.22
169.0306854	0.28
171.1937714	1.32
177.1669769	1.52
180.1190186	1.44
182.2954865	0.96
183.0731201	1.86
184.1322327	0.22
185.1257629	2.32
187.253891	0.49
193.2839813	0.37
195.2186584	1.26
197.1578064	3.34
204.9195862	0.47
209.0610962	1.05
210.0531311	0.32
211.0063782	1.31
212.963623	1.49
218.2448425	0.18
221.0529785	1.79
223.0085449	0.82
224.8956604	1.72
229.1309509	0.53
233.2234802	0.20
235.0368347	0.49
235.8039551	0.31
237.297821	0.28
239.1087341	0.73
241.2408142	0.40
242.1377258	1.49
247.9215698	0.53
251.2467041	1.62
253.1369934	4.98
255.2973938	0.96
265.1170959	7.74
269.4866943	2.26
275.1986389	11.30
276.5556641	0.95
279.058075	0.57
281.3057861	0.64
282.9021606	3.47
283.5802612	0.69
293.204071	100.00
294.0775146	0.65
301.6133423	0.70
311.1190186	0.72
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	293.11
Annotation	L-gamma-Glutamyl-beta-phenyl-beta-L-alanine
Peak:m/z	Relative Intensity
128.0369873	100.00
128.8024139	0.08
130.8483582	0.10
147.1613770	0.19
164.1295471	2.83
249.1149597	0.06
257.0913391	6.41
275.1809692	86.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	479.1193
Annotation	Padmatin 5-glucoside
Peak:m/z	Relative Intensity
143.0226135	0.03
148.1478882	0.02
149.0196838	0.06
150.0774078	0.02
151.3086853	0.07
152.1122131	0.21
152.9833832	0.04
162.0730286	0.03
165.1229095	0.29
166.2475739	0.16
170.1052094	0.05
172.2019653	0.06
174.0339661	0.04
179.0269775	0.22
180.0581512	0.34
181.0643921	0.19
185.6098328	0.01
186.4381561	0.04
187.2266846	0.03
198.1156311	0.05
204.2318115	0.04
205.0375366	0.02
213.0093842	0.02
214.0442505	0.28
214.9381104	0.06
216.1027679	0.22
229.1519623	0.40
230.3243408	0.53
231.1665649	1.39
232.0670166	0.44
233.2113037	0.04
239.0302429	0.03
245.3226471	0.10
246.2973022	0.03
255.2170410	0.13
257.4871521	0.23
258.1778870	0.54
259.3104553	0.12
271.1160583	0.34
272.5451965	0.41
273.1722412	4.71
274.2369385	1.23
275.0894470	0.17
282.4165039	0.09
284.1807251	0.11
285.1361084	0.10
287.3710327	0.17
289.1538086	77.01
290.1701050	20.39
297.0489502	0.01
299.2021790	3.63
300.2204590	1.15
301.3978577	0.04
313.1452637	1.42
314.2035217	0.31
315.4201050	0.15
317.1335144	100.00
318.1358337	24.53
331.1624146	0.86
332.1597900	0.18
335.3536682	0.02
341.0730591	0.12
342.1332703	0.09
343.2426758	0.16
344.1628723	0.14
345.2603455	0.02
346.5828857	0.01
355.1376038	0.07
359.0245972	0.39
360.2980347	0.01
361.3557129	0.05
362.2757568	0.06
369.9693298	0.03
371.6956177	0.10
373.2220459	0.09
373.9181213	0.13
381.9190369	0.02
383.2357483	0.01
386.3430481	0.01
389.2196960	0.09
391.3081970	0.04
393.4882202	0.06
394.5001526	0.03
401.1437073	0.04
402.2027893	0.09
407.3509827	0.04
415.3671265	0.06
417.1944580	0.14
419.4325256	0.09
424.2247314	0.01
426.1529846	0.01
433.1246643	0.42
434.1247559	0.33
435.4956970	0.22
436.5283813	0.06
437.1639404	0.03
438.1138000	0.07
439.3726501	0.02
441.9452515	0.06
444.1696472	0.07
450.1105957	0.02
451.2953796	0.78
452.2846680	0.26
461.2266541	3.10
462.2896118	0.82
479.6884460	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	344.1487
Annotation	N-cis-Feruloyldopamine
Peak:m/z	Relative Intensity
117.0414505	0.45
131.0523834	0.10
132.1360321	0.03
144.9338379	6.41
149.0897369	0.03
151.2555389	0.24
166.0307922	0.25
177.0238342	100.00
178.0836945	0.32
178.9558105	0.05
179.9762421	0.08
181.1848297	0.04
185.0986023	0.05
185.9780273	0.10
189.2909698	0.01
194.1645203	0.24
210.3191833	0.03
229.9950867	0.02
231.6005249	0.02
237.0153198	0.07
238.3832703	0.04
248.1141968	0.04
250.2668457	0.04
254.0842590	0.03
255.8724365	0.04
263.1880798	0.02
267.4040527	0.01
268.8870850	0.03
271.2674561	0.01
272.2644958	0.03
273.6697388	0.07
285.6357117	0.01
287.2492371	0.05
288.2318115	0.01
294.6360474	0.02
295.3541565	0.02
297.2316284	0.03
299.1091919	0.09
303.3585205	0.04
307.3093872	0.19
307.9832153	0.04
308.9380493	0.06
312.1434631	0.13
313.0930176	0.02
316.3333740	0.02
322.0676880	0.06
324.1799927	0.04
325.3113098	0.91
326.2631226	0.48
327.2422485	0.65
328.8030396	0.06
343.6361084	0.01
344.7214050	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	355.01
Annotation	Unknow
Peak:m/z	Relative Intensity
104.9824829	0.50
109.0139389	0.65
110.8940887	1.38
123.1230469	0.15
128.9321899	0.09
138.9908905	0.71
141.0646210	0.48
142.9769592	0.08
145.0789337	0.43
146.9878998	0.76
147.9490967	0.40
149.2518616	0.11
151.1042175	0.08
153.1843719	0.08
155.1120300	0.18
157.1912842	0.13
163.1295776	0.14
166.9597473	1.31
168.9690857	2.18
173.0847168	0.65
175.0517578	1.35
183.1867371	0.88
186.9327393	0.16
195.2266235	0.12
201.0060120	11.56
201.6808777	0.17
203.0792542	0.19
205.2717590	0.20
211.0480042	2.26
212.9028625	2.48
217.1210022	0.07
224.1613159	0.46
231.0712891	0.07
237.0345764	0.08
240.2529297	0.12
241.8468628	0.18
243.1788940	0.06
244.8676453	17.64
245.6003113	0.10
247.0278931	4.26
255.1042786	0.69
258.9147644	8.05
261.0941162	0.51
269.4894409	0.31
275.1795654	0.50
277.1431885	0.26
279.1664124	0.11
280.0592346	0.12
281.2535095	0.10
289.2852783	0.07
291.2349548	0.09
292.9038086	0.24
294.5285950	0.16
295.1825867	0.20
296.3319092	0.11
297.4072266	0.47
300.8803101	0.13
303.0358582	0.13
309.1266174	0.34
311.0017090	1.06
314.1228333	0.12
316.4995422	0.21
318.9260864	100.00
319.5901794	0.30
320.2135315	0.24
326.9843140	0.17
337.0894775	9.65
337.7758789	0.33
339.0928040	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2419
Annotation	18-Hydroxyoctadeca-9Z,12Z-dienoic acid
Peak:m/z	Relative Intensity
70.73427582	0.46
94.81912231	0.22
97.02831268	2.82
108.9906311	0.80
110.9996338	0.34
123.0939636	0.48
124.8928375	1.17
128.7054901	0.42
132.7380676	0.11
137.0631866	0.29
139.0169067	12.27
147.1958466	0.47
148.8914795	0.57
153.1425934	0.41
157.0859528	0.76
163.1817474	0.29
167.1652222	0.43
169.092804	0.21
171.1549377	1.83
173.0904846	0.58
175.2232971	0.46
177.1437683	1.53
179.1971283	0.39
183.2077637	1.24
185.1621704	0.38
191.0434418	0.57
192.8288269	0.12
197.0853729	6.83
201.2067566	0.18
203.1868591	3.34
205.3001709	0.25
211.2385864	2.18
213.2796631	1.76
215.2684937	0.30
217.2433167	0.15
219.2412109	0.27
221.2018738	2.78
225.388855	0.51
227.2571106	0.62
233.1614685	1.14
235.3444824	0.32
237.2870483	5.70
239.2492065	12.29
243.0512085	1.75
243.7114868	1.23
251.2938538	2.17
253.0413513	2.37
255.2727051	0.99
257.1546326	0.27
261.0227356	2.88
263.4696045	0.12
274.6315002	0.20
279.2246094	100.00
280.3925476	1.10
281.0657959	1.66
296.9264526	0.28
298.724823	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	903.4908
Annotation	Macrostemonoside F
Peak:m/z	Relative Intensity
254.7116547	0.19
255.3354187	3.16
257.3478088	0.09
263.3316345	0.28
271.2336731	0.27
273.2761536	10.26
275.0945129	0.03
283.1117554	0.07
285.3052673	1.01
288.5463867	0.07
291.6085205	0.09
297.0771484	0.10
302.8052979	0.06
320.4530640	0.06
321.1006470	0.17
324.8339539	0.80
329.1108398	0.09
331.6512451	0.21
349.4578247	0.21
363.4299316	0.32
381.3912354	0.75
397.1131287	0.33
398.3759766	0.34
399.3436890	3.57
413.4577637	0.04
414.9065552	0.23
415.8751831	0.22
416.7379150	0.63
417.4026489	14.16
434.3909302	0.50
435.2209473	2.16
435.8984375	0.09
441.3261108	0.15
483.7485962	0.09
503.0562744	0.11
507.4732056	0.36
525.2088013	0.18
527.4108276	0.07
535.7814331	0.06
543.3295288	0.30
548.4558105	0.03
561.4489746	1.55
579.3009033	5.62
597.2830200	14.81
600.5962524	0.10
611.4055786	0.15
619.5499878	0.07
680.5021362	0.09
689.6376953	0.06
721.7299194	0.23
723.4695435	2.13
725.7092896	0.33
737.5744019	0.17
739.2642212	0.27
741.3781128	100.00
742.0180664	0.56
751.7921143	0.04
774.1973267	0.23
783.2994995	0.03
806.5173950	0.13
810.7247314	0.03
819.4834595	0.03
848.8601685	0.12
849.5510254	0.36
867.4100952	2.22
868.0923462	0.02
884.2891235	0.19
885.2285767	1.89
885.9208984	0.68
890.6478271	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	412.0656
Annotation	Unknow
Peak:m/z	Relative Intensity
130.3945007	0.15
131.0277100	0.56
136.8990479	3.08
142.9061890	0.77
145.0920105	0.05
147.1519623	0.03
156.1174927	0.04
159.9486542	0.76
162.1130371	0.01
164.7595215	0.03
174.2452240	0.12
175.0947571	0.01
177.0011597	5.52
179.9594421	0.73
183.9445343	0.05
187.3309631	0.03
191.0539551	0.01
201.3511658	0.02
209.0290833	9.20
211.1941376	0.05
217.9469910	0.03
222.1469574	0.05
230.9797974	0.10
247.0961914	0.05
249.1010437	0.04
263.4028015	0.04
265.9711304	3.23
283.0222778	100.00
286.1843262	0.07
288.2688599	0.14
298.0638428	0.05
305.4597168	0.29
306.1004639	4.08
306.8934021	0.15
309.4366760	0.10
313.5516663	0.01
318.9961243	0.85
322.1361694	0.26
323.3171082	0.02
328.1021423	0.04
329.1946716	0.02
331.2687378	0.02
336.9754028	11.14
346.7744141	0.02
348.2601624	0.01
348.9140625	0.30
350.5321045	0.08
352.8906860	0.05
358.3118591	0.07
367.3321838	0.12
369.2671204	0.03
371.2420044	0.08
375.9962463	0.07
383.1274414	0.02
389.8342590	0.04
393.4175110	0.46
394.2019348	2.26
395.0848999	0.63
396.8096008	0.13
403.0726929	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	182.0808
Annotation	4,6,7-Trihydroxy-1,2,3,4-tetrahydroisoquinoline
Peak:m/z	Relative Intensity
70.0801010	0.06
87.7010040	0.12
135.9614105	23.38
164.9375763	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	271.228
Annotation	2-hydroxyhexadecanoic acid
Peak:m/z	Relative Intensity
94.92550659	0.15
107.1829834	0.07
109.046875	0.05
123.0587463	0.18
127.0205231	0.16
143.1879272	0.10
163.2636719	0.08
169.3301849	0.02
176.97612	0.16
182.9531403	0.07
197.3888397	0.07
198.9925079	0.07
205.1576691	0.03
209.305481	0.11
210.9201355	0.26
221.5545349	0.03
223.2665558	0.70
225.2219086	100.00
226.9818726	1.58
227.9485931	0.13
233.1983185	0.11
235.0452118	0.27
237.3100739	0.38
243.5455322	0.12
251.3358307	0.45
252.161911	0.13
253.2176971	4.75
254.0801544	0.04
255.2733612	0.42
271.2879944	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	521.01
Annotation	Unknow
Peak:m/z	Relative Intensity
166.0286865	0.37
183.9981995	100.00
185.0575104	3.02
186.8790741	0.04
230.5434265	0.13
239.9786682	0.03
258.2760620	0.73
287.9846191	0.33
337.2755127	0.27
370.3890381	0.11
379.3582764	0.18
382.9747314	0.23
414.0446167	0.19
435.3648071	0.08
443.4089966	0.13
444.5449219	0.09
449.6685791	0.11
480.3126831	0.04
484.8103638	0.24
489.2319336	0.14
502.4352417	74.30
503.4204102	13.21
504.0307007	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	888.2251
Annotation	Unknow
Peak:m/z	Relative Intensity
250.1429138	0.26
267.8217163	1.06
268.9829407	0.45
286.9961548	3.91
287.7972412	0.06
298.1732178	0.09
303.1399231	0.09
304.7724304	1.22
306.5367432	0.54
307.2479248	0.12
318.4714050	0.20
322.1309204	0.76
323.4210205	0.25
329.4089355	0.66
346.5122070	0.65
347.2508240	0.81
351.1019592	0.72
352.3721619	0.12
356.0582886	0.20
373.2678833	0.78
374.0252686	1.83
378.3466187	0.38
379.3253784	0.30
380.0234985	0.13
381.1708984	0.08
384.0526123	0.15
397.3753052	0.36
399.4878540	0.33
404.1683960	0.56
408.1275024	0.62
416.1455688	0.12
421.2143555	0.07
422.8156738	0.08
431.0131226	4.82
432.2934570	0.32
433.2431641	0.19
434.1661987	0.23
436.3816528	0.23
437.2587891	0.19
451.8818970	1.09
452.8087158	1.57
454.2090454	0.29
462.0486450	0.42
463.0827026	0.56
465.1375732	0.18
466.3426514	0.99
475.2651978	0.19
479.0342407	0.29
479.8997803	2.66
480.6563721	0.62
481.6425781	1.20
482.9959106	0.82
484.3029785	0.24
485.1304321	0.17
499.2807007	0.18
499.8942261	0.23
501.3666382	0.11
505.2737427	0.91
507.6768799	0.24
519.1162109	0.10
520.3114014	0.14
536.9225464	3.66
537.9786987	1.37
548.9187622	0.61
558.0541992	0.47
559.2211304	0.08
562.3148804	0.07
564.3625488	0.17
569.1343384	0.25
571.9844360	1.60
572.7973022	0.39
576.0195312	0.38
578.5374146	0.46
579.1665649	1.27
579.9702759	0.96
592.5387573	0.11
594.0228882	3.62
594.9354248	0.28
596.0957642	0.93
597.4016724	0.11
611.5603638	1.73
612.4662476	0.91
613.1166992	0.09
619.4281616	0.32
620.9903564	0.16
648.4408569	0.22
651.6664429	1.70
659.1801758	2.48
660.5390015	2.93
663.0065308	1.18
664.1085205	0.79
665.5382690	0.66
667.0454712	0.49
668.2603149	3.49
669.4033813	1.72
670.1414185	0.91
670.7794189	0.23
672.5667114	0.05
677.1248779	0.07
678.0779419	0.11
690.2536011	0.16
691.0897217	0.32
692.0905151	0.82
693.5944214	0.43
694.7536011	0.73
700.5504761	1.07
703.1910400	6.63
703.9005737	5.82
707.1264038	0.09
708.1257935	0.72
710.1919556	0.55
713.1262207	0.88
717.3061523	0.22
718.3244629	4.28
722.0396118	0.32
723.0319214	0.70
723.8926392	1.05
725.4890747	0.22
728.2854614	0.71
729.0150757	0.98
734.0359497	0.67
736.8068237	1.41
737.4160767	1.39
738.3401489	0.44
740.6145630	0.45
742.7285156	0.28
744.2928467	0.53
745.1054688	0.70
746.7202148	6.04
747.4800415	1.81
748.7668457	0.32
750.3351440	2.13
754.5460815	0.12
755.4045410	0.65
756.1516724	0.48
757.6466675	0.33
761.5197144	0.88
765.1033325	0.93
766.0026245	1.24
767.0477905	4.65
768.3858032	0.27
769.3071899	0.38
769.9210815	0.08
772.4959717	1.11
774.9179688	7.97
775.8031616	7.57
777.0770874	1.07
778.1430054	1.03
779.1724854	0.38
780.7555542	1.57
782.1143188	5.97
782.9116821	0.31
783.5457153	0.87
784.2319946	0.54
785.3051147	0.89
787.5323486	19.29
788.3982544	0.49
790.4959717	0.15
792.5582886	0.25
796.5028076	0.43
797.5158081	0.41
799.1719971	1.07
801.9248047	0.82
802.5559692	0.43
803.7319336	0.48
804.6748657	1.42
805.3540649	0.36
807.9170532	0.61
809.3651733	3.75
810.1195679	0.54
810.9124146	0.87
812.3960571	0.99
813.4060669	0.24
814.2429199	0.08
815.4553833	2.69
816.6959839	1.60
817.8099976	2.96
818.7308960	5.66
819.5201416	0.16
820.3653564	0.34
822.0468750	1.02
823.3744507	1.52
825.3941040	4.81
826.1754761	2.53
826.9373169	0.11
827.9103394	0.24
828.6952515	2.25
829.5475464	0.22
831.6492310	0.36
832.3156738	0.60
834.2488403	9.92
835.3368530	0.79
836.0330200	0.55
837.1537476	0.83
838.0346069	1.29
839.4235229	13.66
840.2998047	16.72
841.0614624	3.15
841.7540283	2.51
842.8127441	0.43
844.6500854	4.24
845.9304199	100.00
847.3826294	16.46
848.0418091	3.68
849.5337524	1.46
850.3919067	0.93
851.5458374	1.00
853.2418823	1.58
854.2065430	2.18
854.8567505	1.36
858.0935059	3.94
859.2382812	1.35
862.1994019	0.72
863.0017700	4.50
863.8319702	1.54
864.5942993	1.15
865.2825928	3.33
866.3639526	0.97
867.3803101	1.12
868.6412964	2.01
871.0560913	7.36
871.8666992	3.94
872.9134521	4.83
874.9349976	0.28
877.0733643	43.30
878.0879517	2.69
879.0400391	1.59
884.3110352	0.45
892.9090576	0.40
893.7542725	0.23
898.3275757	0.34
903.9890137	0.36
912.9092407	3.57
913.8816528	1.70
918.3532104	0.14
922.7507324	0.29
925.2739868	0.30
932.3970337	0.77
933.0676270	0.99
934.2692871	0.45
940.0145874	1.72
941.3014526	1.71
942.1770630	3.18
942.8724976	0.71
946.8052368	0.58
963.5559082	0.11
966.9929199	0.40
968.4223022	0.24
969.5535278	0.15
970.1668091	0.36
974.2956543	0.22
975.0376587	0.40
976.6337280	0.23
978.8539429	15.98
979.5242310	9.90
980.4854126	2.66
982.2583618	1.47
983.0682983	1.00
986.6220093	0.68
987.4992676	0.21
989.3038940	1.00
990.3718262	3.72
991.1933594	2.05
995.9028931	1.44
998.8627930	5.26
999.7517090	2.33
1000.4397580	0.17
1004.5670780	0.71
1007.3301390	0.59
1012.4747920	0.58
1014.3467410	5.05
1015.4275510	3.64
1016.4414670	3.32
1017.7185060	0.27
1018.7255860	1.62
1020.5027470	1.08
1024.9714360	0.07
1027.4882810	5.84
1028.3642580	1.32
1029.6068120	0.54
1034.2951660	0.46
1035.6784670	13.32
1036.4256590	8.21
1037.0258790	4.38
1041.1208500	0.26
1043.5524900	0.15
1047.6818850	1.53
1049.0594480	1.92
1051.2080080	0.29
1053.8807370	0.39
1055.2749020	4.02
1056.3153080	5.71
1057.8660890	0.48
1061.6186520	0.10
1064.2048340	43.01
1064.8465580	24.34
1065.5056150	16.12
1067.0009770	1.43
1068.0209960	0.70
1069.0870360	0.27
1070.0623780	0.64
1071.8491210	0.35
1075.6086430	1.97
1076.2620850	1.22
1077.3651120	0.62
1078.0876460	0.56
1080.7318120	0.28
1081.5074460	0.32
1082.2629390	0.64
1084.2623290	16.89
1085.0937500	5.49
1087.7839360	0.40
1088.8985600	0.13
1089.9803470	0.29
1092.7058110	64.51
1093.5769040	74.38
1094.6115720	0.93
1095.4228520	0.09
1097.0830080	0.63
1097.9594730	0.68
1099.4123540	0.56
1101.3204350	0.57
1106.2141110	0.28
1108.2043460	0.26
1109.5131840	0.32
1112.9626460	0.42
1114.6125490	3.07
1115.6376950	3.51
1116.7386470	1.31
1118.2708740	0.60
1118.9317630	0.31
1123.7211910	0.16
1124.5673830	0.08
1129.4208980	0.46
1134.7241210	1.43
1136.0656740	0.09
1143.3244630	2.52
1144.3015140	0.60
1146.3288570	0.18
1150.1147460	0.33
1153.7165530	0.58
1154.8214110	1.56
1155.4799800	0.51
1156.1463620	1.59
1156.8525390	0.12
1162.6938480	0.23
1164.4416500	0.87
1170.1618650	0.64
1171.4384770	2.05
1172.0913090	9.57
1172.9887700	3.25
1173.8127440	0.41
1174.7045900	0.10
1178.1679690	0.61
1180.3363040	30.00
1181.0871580	30.24
1182.0360110	1.16
1183.3798830	0.32
1186.6510010	0.44
1187.6662600	0.10
1188.4808350	0.77
1190.0190430	0.38
1197.6383060	0.21
1201.3841550	0.07
1202.3731690	0.15
1215.7592770	0.61
1218.5034180	0.38
1222.4772950	0.38
1223.6572270	1.41
1224.4305420	0.16
1225.8463130	0.35
1230.8011470	0.20
1242.3305660	1.61
1243.3032230	1.21
1244.0721440	0.06
1248.4018550	0.30
1250.3101810	1.55
1251.2526860	1.68
1252.0727540	0.40
1259.0179440	3.79
1259.9234620	7.28
1260.8060300	1.09
1261.4108890	1.73
1262.9693600	0.20
1268.2171630	4.58
1268.8803710	1.27
1276.8878170	0.92
1288.1512450	0.73
1289.4251710	0.25
1305.6987300	0.24
1310.3397220	0.34
1312.3739010	0.12
1328.0415040	0.17
1329.1973880	2.70
1330.1285400	0.93
1331.3477780	0.17
1334.4830320	0.07
1345.9812010	0.18
1348.7697750	0.20
1362.2592770	0.84
1379.4056400	0.09
1381.6435550	0.23
1392.6585690	0.51
1394.3851320	0.12
1397.3247070	0.20
1426.4410400	0.10
1460.2579350	0.80
1461.9322510	0.25
1485.8863530	0.10
1487.8653560	0.13
1502.9995120	1.52
1504.2647710	1.14
1505.1474610	0.71
1506.1204830	0.34
1520.5040280	0.40
1521.7325440	0.70
1522.6256100	0.62
1555.5235600	0.12
1559.2445070	0.18
1574.7476810	0.08
1577.3524170	0.13
1618.5759280	0.27
1632.1389160	0.08
1634.7254640	0.35
1648.8668210	0.93
1650.1478270	0.77
1651.5886230	0.70
1654.1639400	0.12
1707.0036620	0.23
1756.5084230	0.26
1825.7072750	0.41
1826.3304440	0.09
1880.5778810	0.46
1881.5524900	0.44
1925.9874270	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	478.2915
Annotation	PE(18:2(9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
142.1966095	0.01
150.7488251	0.01
153.0571289	0.04
161.2064209	0.06
177.3215637	0.01
180.3167419	0.02
187.1997070	0.04
198.0050659	0.13
215.9822083	0.10
245.3771667	0.05
263.2800598	0.17
306.3368225	0.33
312.7298584	0.02
324.3711853	0.03
337.2575684	100.00
373.1066284	0.02
380.2964783	0.15
388.6097717	0.03
404.2091370	0.06
417.3035583	0.12
435.1194763	0.12
442.9635925	0.03
460.2868347	5.02
463.1413269	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	454.1125
Annotation	Unknow
Peak:m/z	Relative Intensity
137.0623932	0.02
143.7914581	0.23
146.9494324	0.82
147.8263397	0.26
156.0366516	0.11
160.1654205	0.05
162.0307007	2.02
166.1280823	0.03
169.9863281	0.69
173.3183289	0.06
175.3966370	0.05
176.9931335	0.20
179.0096436	6.88
183.8679504	0.04
188.0411682	0.09
199.0835724	0.08
202.0760803	6.55
211.1635132	0.21
215.1174622	0.18
219.0615845	100.00
219.6778259	0.15
221.9407501	0.72
228.9442902	0.02
231.1162720	0.13
233.1543579	0.16
244.8799133	0.31
251.1147766	9.92
255.0553894	0.06
273.1019287	1.46
281.5658875	0.07
284.1434631	0.06
290.2446594	0.11
290.9810486	0.07
292.1611938	0.13
305.0722046	0.17
306.1511841	0.10
308.1712646	9.78
312.3015137	0.07
323.1478882	0.02
324.9592285	60.40
325.8703613	0.04
330.1813049	1.91
340.3312073	0.07
346.2521057	0.04
348.1341553	74.29
348.7505493	0.13
353.9937744	0.14
358.3451843	0.07
361.2278137	0.23
364.1761475	0.12
371.3037109	0.05
379.0170898	10.64
380.1350708	5.54
401.6363831	0.05
408.3193054	0.14
409.4235840	0.18
413.2983704	0.13
416.2232666	0.04
417.3684387	0.10
427.4068298	0.04
436.2902222	1.61
437.0789795	0.26
444.3103333	0.20
445.0297546	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	382.1698
Annotation	(R)-Pantothenic acid 4'-O-b-D-glucoside
Peak:m/z	Relative Intensity
120.0411224	0.32
121.8102417	0.03
137.0611877	0.14
142.0983582	0.05
143.8459473	0.09
153.2301941	0.05
160.3359070	0.07
166.1387024	1.63
174.1973877	0.11
184.1599579	0.47
199.1791840	0.09
202.0402527	2.33
204.0343933	0.03
205.0197144	0.08
208.0835571	0.35
214.9237061	0.09
217.0833130	0.11
220.1050415	100.00
224.1122742	0.17
234.2896423	0.18
235.2541504	0.17
244.9545593	0.10
253.1319275	0.03
260.0709229	0.03
281.9565430	0.08
283.7869263	0.03
284.3879700	0.05
292.1088867	0.11
295.2462769	0.13
298.3213501	0.02
301.6326904	0.22
304.5134888	0.06
318.3606567	0.05
319.5658569	0.13
322.3148804	0.06
328.1018982	0.03
338.1983643	0.03
340.7706604	0.06
346.0640564	0.55
350.3187256	0.16
353.6833801	0.08
363.2621460	0.26
364.3755188	0.72
365.0803223	0.03
372.6014709	0.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	451.1987
Annotation	8-Isobutanoylneosolaniol
Peak:m/z	Relative Intensity
141.9380188	0.49
169.1807098	0.08
171.0705261	0.25
173.0429535	0.36
178.5413208	0.05
185.1926880	0.52
195.1352844	0.29
203.1388550	0.27
209.4244690	0.05
230.2544403	0.05
231.2417450	0.04
237.2993622	0.17
249.1497192	0.06
251.1223450	0.04
256.4717102	0.09
261.2362061	0.17
262.2727051	0.34
263.1441956	0.19
265.0046997	0.66
267.2208557	1.66
268.1672058	0.23
271.2606506	0.27
273.5691833	0.28
275.1235046	0.12
277.1716003	0.12
279.1815491	2.70
280.2321777	0.25
283.0205078	0.10
286.2302856	0.05
288.2659607	0.24
289.3800659	0.20
290.6701660	1.13
291.3208923	2.43
294.0943604	0.74
299.7539673	0.23
301.1719360	0.05
302.2428284	0.42
303.4338989	0.08
304.5010071	0.08
306.2175903	1.95
308.1862793	11.56
310.2970886	0.06
312.2091675	3.41
314.4885254	0.10
316.0653992	1.74
316.8319702	0.04
318.2582703	0.33
319.0267334	0.18
322.2972107	5.74
323.1309204	0.05
333.1534424	0.20
334.2582092	16.11
345.4177246	0.15
346.7953186	0.20
347.4328003	0.19
352.2268066	0.06
355.7214355	0.54
361.2510376	0.23
362.8896790	0.05
364.3218079	0.96
372.5525208	0.63
377.3334045	0.14
379.0154114	0.10
389.3071289	0.95
390.3084412	1.85
391.2216797	0.18
395.2546692	0.08
405.3096924	1.22
407.2896118	100.00
408.0563049	0.69
410.0554199	0.23
415.2850647	0.35
416.2402649	0.57
421.3627014	0.12
424.1419067	0.05
428.4782410	0.10
431.3309631	0.42
433.2464294	40.77
434.3133545	0.69
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	275.1594
Annotation	Unknow
Peak:m/z	Relative Intensity
82.8880005	3.68
84.0257568	0.11
85.9133911	0.10
100.0463333	25.10
102.0378113	0.04
111.9242554	0.06
115.9303436	0.09
120.2237167	0.07
122.0701141	0.04
123.9507751	0.09
125.8644257	0.10
126.9989700	0.04
129.9649963	0.57
133.2359619	0.08
133.9412994	0.11
138.1263123	0.02
146.0066223	100.00
148.0581970	0.44
149.9306641	0.20
152.0129089	0.49
156.9710388	0.03
161.2302094	0.05
163.0025940	0.09
164.8813019	0.04
168.8830566	0.03
172.0695801	0.07
175.2142792	0.05
185.0465546	0.62
187.1504211	0.11
197.1407471	0.22
201.0715027	0.08
203.1945190	0.23
210.8737183	0.22
212.1367493	5.32
213.3700562	0.11
214.8716125	0.05
223.0117798	0.05
229.0082703	0.98
229.7210083	0.36
231.1191101	0.07
234.1423645	0.06
239.0256042	0.72
241.9757690	0.02
247.2299805	1.03
254.2365723	0.24
257.0964966	6.54
258.1083679	29.79
265.9668884	0.82
266.7797241	0.28
287.9853516	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	355.04
Annotation	BM 2419-1
Peak:m/z	Relative Intensity
102.0042191	0.06
103.8893967	0.11
116.7501068	0.21
119.8357544	2.16
121.7840576	0.23
124.0233994	0.11
127.9872894	0.08
130.2418518	0.28
136.7739563	4.61
147.8998413	0.08
149.5441437	0.22
151.9354553	23.88
159.2340088	0.17
160.0329895	0.14
160.7490234	0.06
163.0589600	0.05
166.2675171	0.07
169.1905060	0.05
173.0782166	0.09
174.8493958	0.14
176.0829010	0.21
179.7486115	0.27
181.0891113	0.17
183.9958801	0.52
188.0466461	0.23
189.0691223	0.28
205.0411682	3.58
206.0464478	0.07
208.7384644	2.82
210.1414795	0.12
213.2432556	0.07
214.0225220	0.10
215.6359253	0.08
220.7292175	0.48
221.8035889	0.44
225.9977112	100.00
231.0164490	0.28
232.1119995	0.31
234.1084900	0.12
239.1109619	0.15
249.0729065	17.22
253.2839661	0.29
262.9125977	0.36
264.2463989	0.65
265.1952515	0.45
267.3160095	0.26
273.1958008	0.09
276.0863647	0.04
280.1634216	0.05
281.0639038	0.59
282.1604614	0.24
283.0598145	0.05
290.3899536	0.20
292.1143799	2.50
293.9726257	0.15
296.0606689	0.19
297.6640625	0.08
301.1217957	0.46
301.7568970	0.28
307.3750305	0.16
308.2366333	0.07
309.1119385	0.36
310.1680298	0.93
311.3684998	0.16
314.0081177	2.05
317.7929382	1.01
319.0697021	0.29
322.3860474	0.10
323.1957397	0.19
324.3016968	0.44
325.4038086	0.11
327.4553833	0.11
331.9726868	0.17
336.3936768	4.65
337.2605286	6.44
338.1333618	7.45
340.0933228	0.08
343.2031555	0.59
345.6707764	0.64
347.8138123	0.57
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	426.1338
Annotation	Unknow
Peak:m/z	Relative Intensity
125.0219803	0.04
128.0255737	0.69
136.8849792	0.08
146.1374512	0.39
149.1189270	0.26
150.0556488	0.54
153.0820312	0.26
162.0742950	0.65
172.1065826	0.18
179.1183777	0.16
189.0499878	0.69
197.3391113	0.09
212.2685242	0.15
226.5906677	0.12
233.1604004	45.81
249.1777649	0.08
252.1589661	0.07
256.2313232	0.05
257.0991516	1.82
264.2832336	0.07
265.0329285	0.04
272.2936401	0.27
274.2764282	0.17
275.1646423	1.52
279.1737366	0.25
290.0317383	0.08
292.4062805	0.80
294.2218018	0.09
297.2066040	3.37
298.1468506	0.12
300.2673035	8.32
318.2279053	27.84
326.2369690	0.24
328.2110596	0.60
333.2722168	0.19
334.4253235	0.10
344.1443787	13.66
346.4636841	0.28
362.2331848	100.00
364.1953735	0.87
365.2100830	0.07
366.4772949	0.18
367.2355652	0.12
378.3318176	0.07
379.1964417	0.44
380.2041016	0.57
381.2804260	0.17
382.0137024	0.13
393.0325623	0.07
396.8692017	0.09
408.1230774	12.75
409.0341187	0.07
409.8897400	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	298.11
Annotation	3'-O-Methylguanosine
Peak:m/z	Relative Intensity
86.0009689	0.08
119.0103760	0.37
119.9550629	0.09
136.0216370	0.16
137.1170044	0.05
140.0278320	0.07
148.9741821	0.11
151.2070465	0.30
152.0737305	0.74
153.2145844	0.16
155.3420410	0.02
161.0542755	0.03
162.0231628	0.04
166.0058441	100.00
169.0214386	0.08
172.1080017	0.08
174.1537323	0.05
180.1240845	0.06
183.0183716	0.05
183.8723450	0.04
186.1635742	0.26
189.9380951	0.11
193.1132202	0.13
193.7759247	0.02
198.0661621	0.22
208.1204834	0.26
213.9785461	0.08
224.1311340	0.02
227.6636353	0.06
234.1480713	0.07
236.3264160	0.06
237.3533630	0.06
237.9922485	0.14
239.0693054	0.06
244.2458191	0.14
245.3800659	0.09
252.0341187	0.47
252.9400024	0.04
254.9094238	0.10
256.8106079	0.20
261.0809937	0.06
262.9524841	0.77
266.0580444	0.05
267.3080444	0.22
275.3479004	0.23
280.1123657	2.26
281.0630798	0.39
282.1161499	0.02
288.9714661	0.39
290.1671143	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	330.1194
Annotation	5'-O-beta-D-Glucosylpyridoxine
Peak:m/z	Relative Intensity
99.0353546	0.02
111.0936661	0.01
119.1190948	0.04
121.9644852	0.12
129.1753540	0.01
130.6990356	0.01
136.0842285	0.31
141.1136169	0.01
146.0976868	0.04
150.0613403	1.50
152.1035919	0.37
158.1808777	0.05
159.9915466	0.07
162.0730286	0.03
164.2860565	0.05
168.1192627	0.06
168.7356415	0.02
174.7422180	0.17
176.1442108	0.51
178.9931946	0.02
188.1922607	0.01
190.2316284	0.01
192.0905457	0.06
194.1410980	0.17
204.1002808	0.51
205.9667511	0.08
210.1130066	0.06
216.3461609	0.03
220.3722839	0.02
222.1047668	0.74
224.0430603	0.02
252.1190796	0.17
268.1479797	0.02
269.9282227	0.01
283.9447632	0.05
300.2088623	1.66
312.1678772	100.00
312.9709778	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	763.1898
Annotation	Unknow
Peak:m/z	Relative Intensity
241.1637573	0.03
250.1448669	0.05
259.2188110	0.33
281.0740356	0.01
323.2182617	0.18
328.0422363	0.05
341.0187378	1.08
383.2356567	3.60
395.2448120	0.21
419.8745117	0.10
421.3525391	0.15
424.9154663	0.03
439.3043213	0.27
442.3998413	0.16
443.0989380	0.66
462.9703979	0.10
485.2787476	0.91
503.2388306	0.89
503.8631592	0.05
519.2102051	0.11
523.0124512	0.16
523.6235352	0.04
545.3739624	0.03
547.3451538	0.02
565.1389160	0.13
583.2450562	0.82
601.2146606	5.82
665.2992554	100.00
665.9208984	0.19
745.3949585	11.58
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1313.4265
Annotation	Maltooctaose
Peak:m/z	Relative Intensity
383.2813416	1.44
395.0352173	0.78
430.4739380	0.20
443.0638123	0.27
449.3504944	0.25
468.8780518	0.35
485.2601929	6.25
503.3242188	4.28
505.1924744	0.11
515.3140869	0.14
527.4160156	0.22
539.0866089	0.31
545.2656250	10.01
557.5543213	0.46
575.1070557	0.38
585.0501099	0.13
586.9096680	0.07
601.2158203	0.64
611.1148071	0.36
629.6181641	0.62
647.2885742	8.78
665.2331543	11.75
705.4816895	0.11
707.3105469	35.36
719.5615234	0.11
731.3157959	0.26
737.2872314	2.30
749.0873413	0.97
761.3883057	0.20
775.5374756	0.38
809.3663940	25.06
827.3380127	39.31
867.4326172	0.08
869.3144531	14.41
883.3968506	0.09
897.3751221	0.28
899.1612549	0.24
900.7703857	0.30
971.2994385	23.00
971.9179688	0.08
989.4051514	41.10
1031.3259280	18.37
1061.3732910	0.72
1063.6757810	1.26
1133.3360600	12.69
1151.4343260	100.00
1152.5461430	0.13
1193.3706050	0.63
1223.4470210	1.55
1224.1832280	1.13
1295.2902830	2.48
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	842.179
Annotation	Unknow
Peak:m/z	Relative Intensity
265.1272888	0.49
282.0112000	0.03
286.9263306	0.06
305.1510620	0.29
306.3119202	0.05
308.2013550	0.02
310.0940857	0.03
311.2902222	0.19
315.3241577	0.05
318.1732788	0.06
322.1306152	0.03
331.1111755	0.02
340.1764526	0.11
352.0878906	0.15
355.1998596	0.06
359.3536987	0.08
360.1205444	0.05
363.0150757	0.05
364.0311890	0.09
366.1022339	0.06
378.0333252	0.09
385.1883850	0.13
392.2736206	0.05
400.0974121	0.09
403.4283447	0.03
406.1220093	0.03
407.5007935	0.03
408.1260986	0.12
409.1453857	0.42
417.3004761	0.07
429.4222412	0.07
431.1835327	0.14
434.2335815	0.46
435.9471436	0.05
440.5715942	0.08
445.0023804	0.43
446.2601318	0.09
455.9067383	0.09
458.0601807	0.15
463.5491333	0.16
464.1809692	0.22
474.2020874	0.05
477.5872192	0.14
478.2924194	0.02
481.4976196	0.16
483.1807251	0.33
485.1488037	0.09
491.0964355	0.05
498.1571045	0.07
503.2037964	0.23
504.2477417	0.13
508.9617920	0.45
513.2395630	0.02
514.3084106	0.17
515.1842041	1.13
519.0987549	0.10
520.2392578	0.59
532.4364014	0.10
535.3806152	0.16
537.1668091	0.23
538.3021851	0.58
539.2342529	0.35
546.2553711	0.44
549.2830200	0.02
551.2019043	0.03
556.0711670	0.01
557.0996704	0.08
564.1986694	1.00
565.1464233	0.06
565.9646606	0.03
567.1520996	0.03
569.3442383	0.24
570.1679077	0.08
574.4725342	0.33
575.2534180	0.38
578.4559937	0.04
584.0958862	1.46
587.6480103	0.17
589.0786133	0.06
592.2260132	0.33
593.1635742	0.49
594.1978760	0.23
597.5421143	0.05
602.2824097	0.11
603.4276733	0.02
607.3505249	0.53
610.0975342	0.89
612.1884155	0.33
612.8288574	0.08
620.2102051	1.13
621.3394165	0.20
626.2213745	5.86
629.0704956	0.05
631.5026245	0.05
638.1687012	30.46
639.0846558	0.65
643.3818970	0.23
644.1892090	2.23
648.0324097	0.06
649.3815918	0.26
650.2795410	0.09
652.5253296	0.06
657.4290161	0.39
660.2686157	0.05
661.3993530	0.17
667.3525391	0.10
668.1407471	0.21
672.1613159	0.66
675.0092773	0.11
677.0230103	0.29
679.5177612	0.09
685.3815308	0.24
686.1448975	0.25
693.4009399	0.96
695.2745361	2.59
704.0009766	0.68
705.3447266	0.05
713.2125244	100.00
713.8560181	0.44
718.0964966	0.24
721.2733154	0.19
722.2419434	0.25
726.1946411	0.06
731.3710327	0.05
732.2745972	0.02
736.3304443	0.24
739.2833862	0.42
740.1896973	0.06
743.6732788	0.09
749.2329712	2.31
750.2164917	0.29
761.2359619	0.13
766.6813354	0.96
767.2862549	16.40
768.2218628	0.07
778.0986938	0.08
779.1572876	0.45
780.2203979	0.12
781.1199951	0.08
796.3734741	0.13
797.3091431	0.21
798.0930176	0.06
801.1831665	2.28
804.5680542	0.16
805.1974487	0.01
806.2445679	0.49
820.5236206	0.05
824.2113647	8.10
825.3915405	0.53
829.1715698	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	652.1756
Annotation	Unknow
Peak:m/z	Relative Intensity
187.0602722	0.20
192.9992218	0.20
199.2319946	0.19
201.9903107	0.58
207.2917175	0.12
208.9781799	0.25
216.8781128	0.15
218.9839783	1.15
222.1843567	0.06
231.1766357	0.06
233.1987000	0.09
243.3196106	0.21
244.8131409	0.20
252.9081116	0.13
255.0527191	0.13
256.2565613	0.29
265.1736450	0.06
268.2985229	0.04
273.1641541	1.97
282.1431885	0.14
285.2713623	0.30
287.1204224	0.65
288.3071899	0.45
290.8292236	0.23
291.9571533	0.09
298.0598450	0.08
305.1424561	1.06
306.0468140	0.35
309.3542786	0.08
316.0488892	0.28
317.3000488	0.13
319.0317993	0.69
322.0929260	0.12
323.3178711	0.11
324.9624634	0.39
328.0431213	0.21
330.0998535	0.16
331.0950012	0.05
338.2023315	0.06
342.1896362	0.07
346.2294922	0.59
348.1394043	5.32
348.8580933	0.03
353.0877075	0.17
354.1929321	0.04
356.1204834	0.74
356.8278198	0.03
357.4978027	0.05
360.1018677	0.58
360.7037964	0.06
367.4945068	0.06
374.1871948	2.76
377.9058838	0.33
378.5104980	0.05
380.1884155	0.23
381.4816895	0.08
388.1253052	0.10
392.1345825	0.44
397.1227417	0.07
402.1301270	0.48
403.1372070	0.10
406.2986450	0.37
412.4223633	0.13
413.0384521	0.09
416.0691528	0.48
420.2074585	2.14
427.2083740	0.23
429.9031982	0.79
431.2244263	0.20
434.1806641	0.40
439.7894287	0.03
440.5256348	0.07
442.0443726	0.18
447.9830933	8.45
449.1909180	1.91
453.1965332	1.10
459.0599976	0.08
462.8538818	0.10
463.4638062	0.14
466.9547119	0.27
471.4472046	0.22
472.1677856	0.44
482.1316528	0.58
485.1975708	2.51
486.7391968	0.15
487.9862061	0.45
495.9705200	0.11
497.5123901	0.08
503.0880127	3.48
504.9274292	0.48
506.0833130	0.15
511.0319214	0.09
514.0635376	0.27
518.4597778	0.07
523.2518311	100.00
526.1716919	0.04
528.1989136	0.51
531.2170410	0.07
537.3182983	0.18
538.3930054	0.13
541.0338745	0.26
546.1739502	0.60
547.0889282	0.15
549.0122681	0.15
549.7795410	0.62
551.9641724	0.38
554.9852905	0.19
559.1198730	1.82
560.1193848	0.79
561.6239624	0.75
562.4472656	0.28
565.1080322	0.12
570.4724731	0.07
577.2722778	11.88
589.0125122	0.20
591.5269775	0.08
596.4236450	0.05
606.3676758	0.46
609.9432983	0.04
611.3370361	1.86
616.3126831	0.27
617.2638550	0.08
619.2395630	0.20
623.5813599	0.09
631.5206909	0.22
633.5995483	0.27
634.3125610	3.61
635.3410034	4.65
635.9430542	0.07
642.6681519	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	815.1888
Annotation	Unknow
Peak:m/z	Relative Intensity
243.0912781	0.03
245.3473511	0.01
255.0826111	0.02
256.3076477	0.10
271.0896912	0.22
272.2646484	0.03
287.2639771	0.05
300.1295166	1.32
301.0472717	0.24
303.3100586	0.03
313.2775879	0.01
315.1359558	10.12
316.2162476	2.48
323.4479370	0.03
329.2429810	0.05
343.4669189	0.11
357.0354614	0.13
358.3724670	0.07
368.8339844	0.01
383.2222900	0.07
387.4945679	0.07
400.4265137	0.02
411.4187622	0.16
439.3342285	0.01
446.9827881	0.03
459.3527832	0.07
474.4406128	0.03
477.4505005	0.03
490.0798950	0.04
491.2031860	1.05
492.1725464	0.17
500.2870483	0.13
506.8894653	0.03
518.3713379	0.02
532.1359863	0.04
533.6270142	0.06
557.3055420	0.02
558.4633789	0.07
559.2610474	0.03
577.8526001	0.05
592.5392456	0.07
594.2411499	0.01
607.6548462	0.02
610.4487915	0.02
611.3550415	0.17
612.4063110	0.07
617.5778198	0.11
625.2707520	0.38
626.2360229	0.05
635.4948120	0.04
639.2639160	100.00
640.3167114	31.69
641.7005615	0.05
653.6856079	0.07
667.2143555	0.03
681.2709351	5.90
682.3654175	1.67
684.3563232	0.07
693.3279419	0.02
694.4009399	0.05
696.5474854	0.03
707.2214355	0.02
709.2559814	0.25
711.2122192	2.59
712.2764893	0.95
717.0429077	0.09
717.9700317	0.06
721.4558716	0.02
723.3225098	0.36
724.4573975	0.25
725.6018677	0.06
735.2431030	0.63
736.3058472	0.30
740.2640991	0.03
741.2857056	0.02
753.3539429	0.52
754.4534912	0.08
756.1549072	0.07
757.4934692	0.05
771.4020386	0.13
774.2203979	0.03
779.0352173	0.06
797.2210693	0.87
798.1194458	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	394.1266
Annotation	(gamma-Glutamyl-gamma-glutamyl)-S-methylcysteine
Peak:m/z	Relative Intensity
116.0575562	0.04
125.2991791	0.01
127.1345749	0.08
130.0717773	0.06
144.0314178	0.34
145.1073914	0.02
162.0266724	2.71
172.0581970	0.48
181.0860596	0.03
229.9592590	5.07
247.1716614	3.83
248.0914917	9.22
256.1696777	0.04
265.0424805	100.00
274.2998352	0.08
283.0841675	0.01
290.0538025	0.06
290.8835449	0.40
301.1251526	0.20
319.2002563	4.12
331.1676025	0.22
358.3001404	0.05
376.1502991	1.89
377.3120422	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	234.08
Annotation	5-Chloro-1,3-dihydro-1-(4-piperidinyl)-2H-benzimidazol-2-one
Peak:m/z	Relative Intensity
72.6933975	0.02
87.8968048	0.26
99.8901367	3.00
102.0615997	0.18
115.9212494	0.03
126.0213318	11.31
143.9652252	100.00
144.7615509	0.03
145.8603668	0.09
147.2132568	0.09
160.0878754	0.06
164.9128265	0.04
172.0401001	0.17
178.0330963	15.96
178.8920441	0.04
189.3902435	1.13
189.9971466	4.28
197.9720306	0.04
206.1823883	0.08
215.0344543	0.15
215.7812653	6.00
216.5106812	0.03
217.1135101	0.08
219.1773071	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	261.15
Annotation	Cordiaquinol J
Peak:m/z	Relative Intensity
82.93540955	0.30
88.97825623	0.07
92.94639587	0.42
96.98283386	0.08
137.0913696	0.17
148.1222687	0.21
156.984314	0.32
165.1900635	0.13
171.0353394	0.14
172.8855591	0.27
187.2065125	0.15
189.2162018	0.18
192.9898376	0.15
197.177597	0.25
201.0599365	0.60
205.8240356	0.05
215.0076294	1.04
217.041214	0.87
219.1201324	0.20
225.0032501	0.35
227.1868134	0.17
243.1488037	100.00
245.2234344	2.51
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	539.14
Annotation	Unknow
Peak:m/z	Relative Intensity
161.0452271	0.06
178.9474182	0.30
184.9932861	0.01
195.1572266	0.16
197.0202789	0.01
218.8178711	0.03
221.1279755	0.10
233.0146027	0.26
250.6690979	0.03
269.0939331	0.02
275.2500000	0.12
323.2058716	2.15
341.0685425	0.63
359.1144409	1.00
377.2276001	0.52
383.2656860	0.05
395.1079712	0.12
413.0554199	0.05
425.0006714	0.02
443.0926514	0.09
485.5570679	0.05
503.2380371	100.00
503.8416138	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	294.0983
Annotation	Indican
Peak:m/z	Relative Intensity
85.0074997	0.16
100.9797058	0.67
111.8711395	0.25
128.9581299	21.83
144.2045898	0.04
146.8202209	0.20
154.1303711	0.08
164.0570374	2.75
165.2961121	0.17
175.5379639	0.03
191.5081787	0.05
204.1955872	0.12
232.2615662	0.14
242.4343872	0.04
244.2017822	0.05
245.0061646	0.05
247.2333984	0.03
247.9489746	0.13
250.1810303	0.26
251.3318787	0.04
258.0175171	0.03
265.0534363	0.03
276.1170654	100.00
279.2146912	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	919.4919
Annotation	Trigofoenoside B
Peak:m/z	Relative Intensity
301.6438599	0.03
319.7896423	0.06
323.4163818	0.13
397.4083252	0.03
433.5586548	1.31
475.9249268	0.02
476.9763794	0.02
532.5192871	0.03
561.1036377	0.09
575.8985596	0.02
577.4967041	0.82
578.0997314	0.01
595.5079346	5.62
634.0391846	0.03
637.0360718	0.07
665.2139282	0.07
666.0138550	0.01
709.4125366	0.09
713.4872437	0.04
717.8954468	0.04
719.3448486	0.10
720.8167725	0.05
721.9953613	0.03
725.9134521	0.21
737.4960327	0.16
739.4874268	8.93
740.2402954	0.03
755.6395874	0.04
757.5018921	100.00
758.1908569	0.20
799.6334839	0.05
835.6494751	0.05
876.0313721	0.07
898.0289917	0.03
901.5334473	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	283.18
Annotation	Manilamine
Peak:m/z	Relative Intensity
97.11828613	0.04
107.7593994	0.05
108.9199142	0.03
112.0137177	0.24
112.9587402	0.42
114.1194458	0.09
120.0055618	0.46
124.8770599	0.03
126.0548859	0.84
129.0856171	0.08
133.1124878	0.07
137.0894165	0.03
145.3985901	0.08
149.1222839	0.03
151.2836761	0.02
151.9860535	0.12
155.188736	0.05
162.1658478	0.75
169.058197	0.13
177.1869507	3.91
178.1721497	0.09
180.0324707	0.41
181.5409241	0.02
190.1443481	0.05
192.2481689	0.05
194.2220459	0.04
196.160553	0.28
197.1340942	0.20
205.0520935	5.81
205.677002	0.03
206.2921448	0.20
209.3421631	0.04
219.9225769	0.47
221.0857239	4.31
222.3053894	4.39
223.2170105	32.91
224.091095	2.37
224.8155823	0.09
237.1916504	0.53
238.1299133	0.13
239.3230591	5.08
241.1009521	0.15
246.2634583	0.13
247.019043	0.21
248.2068176	0.68
249.1172485	0.08
254.1022339	0.06
254.9669189	0.05
261.2059631	0.02
265.1635742	100.00
266.2851562	7.52
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	316.2839
Annotation	Halisphingosine A
Peak:m/z	Relative Intensity
89.96470642	0.16
90.72478485	0.04
92.9993515	0.15
94.94872284	1.27
95.98927307	0.03
96.99542236	0.47
98.03450012	0.04
99.83181	0.16
101.9339828	0.11
104.9981384	0.09
106.9963379	0.22
108.9079132	0.72
110.9987335	0.34
112.9084091	0.16
118.9561615	0.10
121.0742722	0.77
122.960083	0.73
124.1916351	0.30
125.0580292	0.68
129.0706177	0.12
129.8594055	0.05
133.1215668	0.81
135.0693817	1.02
137.0629272	1.36
138.769577	0.21
140.2428894	0.07
142.7832336	0.08
147.009552	0.50
148.9723511	0.99
151.0545502	0.70
153.1508484	0.07
155.1123962	0.43
156.2419128	0.09
157.2217102	0.25
160.9785767	1.13
163.0825958	0.24
165.2099762	0.26
168.1327667	0.08
169.1852112	0.04
174.3294067	0.12
175.2652283	0.13
177.1116333	0.16
189.3911438	0.08
191.1977234	0.26
193.2394714	0.10
196.3362732	0.16
198.4296722	0.16
207.1906433	1.71
210.1831055	0.14
210.932312	0.08
212.2097473	0.04
214.4655457	0.17
216.12854	0.04
219.217804	0.21
221.2077332	1.87
224.2394104	0.09
225.2396851	0.16
227.0748291	0.41
228.1521606	0.04
233.2331238	2.42
234.3075562	0.13
236.0941162	0.19
237.426178	0.88
238.4729309	0.30
239.3839417	1.74
242.3810425	2.22
245.2869263	3.04
250.3230591	1.98
251.2920227	2.54
252.362793	0.20
253.0603333	0.17
258.428772	0.10
262.312439	4.17
263.3309631	2.61
267.1221008	0.19
268.2490234	2.61
269.0597839	0.08
270.3768921	0.07
271.1807861	0.07
272.2254028	0.27
273.364624	0.12
275.1277466	0.04
280.3322754	56.96
281.2808228	0.32
282.1002197	0.27
285.4294128	0.19
298.2799683	100.00
299.0231323	2.39
302.2721558	0.22
302.961731	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	711.2194
Annotation	Unknow
Peak:m/z	Relative Intensity
368.4914551	0.05
369.2461548	0.02
412.7536621	0.03
430.4937134	0.02
441.3629761	0.02
535.3048096	0.05
665.2831421	100.00
691.5155640	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	865.24
Annotation	Unknow
Peak:m/z	Relative Intensity
323.2364197	0.03
324.0236206	0.05
341.1680908	0.17
342.0054321	0.20
383.4721069	0.18
384.4743652	0.06
395.3309937	0.11
400.4870605	0.05
412.8933716	0.06
443.1864014	0.03
503.1915283	0.22
503.9624023	0.10
539.4507446	0.07
541.3436890	0.02
545.2866821	0.20
546.1342163	0.19
600.6142578	0.03
630.5542603	0.06
647.4736938	0.15
648.2892456	0.07
649.5844116	0.10
665.2379761	0.12
666.2355957	0.30
666.8762207	0.05
685.4668579	0.11
702.6593018	0.12
703.2744751	0.11
707.4812622	0.05
708.1885376	0.11
808.3267212	0.06
827.3286743	59.81
828.3046875	100.00
829.3225098	21.23
829.9453125	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	438.0455
Annotation	Unknow
Peak:m/z	Relative Intensity
129.8980408	0.05
130.8077545	0.05
136.8981018	0.72
139.9945984	0.93
141.2247009	0.19
142.5259857	0.86
143.1296082	1.07
143.9240112	0.09
144.9728699	1.30
149.0720978	0.27
151.9925385	0.18
153.1588898	0.04
156.0521240	11.74
156.9677734	0.71
161.0101471	0.12
165.0002747	0.14
167.0715179	0.37
168.1383057	0.33
168.8799744	0.38
169.9240570	0.07
174.1241150	0.03
174.9214325	0.10
176.2936401	0.21
177.0321350	0.89
177.9675598	4.83
179.0440674	0.23
180.2759705	0.05
182.1004333	5.51
183.0627747	0.54
184.2643890	0.69
185.1396179	1.53
188.7723389	0.23
190.1481171	0.11
196.1204224	0.38
198.9802246	1.11
200.9251709	0.97
202.1749878	0.17
207.3666687	0.13
208.9810791	2.01
209.7988739	0.08
211.0948944	0.48
214.0002136	11.34
215.0568237	0.58
215.8233948	0.23
217.0942688	0.35
218.2280579	0.86
219.0910034	1.20
222.9287109	0.29
225.6365509	0.27
226.9732971	2.04
228.0755920	36.40
236.9669800	0.10
238.1665649	0.10
239.1878967	0.03
240.9343262	0.29
242.9124756	0.04
243.5327454	0.08
249.0859985	0.72
251.0574951	0.22
253.3168030	0.06
260.0187988	100.00
260.9660645	0.45
263.2286377	0.11
272.1350708	0.24
273.2938538	0.25
275.6174622	0.71
276.3276978	0.41
277.4578552	0.15
279.1845093	0.13
282.8817139	3.60
286.0223999	0.06
291.0130615	0.33
292.0122681	2.19
299.2507935	0.11
300.0365601	0.29
309.4238281	0.07
323.7476501	0.12
329.3751221	0.28
330.1490784	0.10
332.0266724	63.60
333.0622559	1.86
336.6251221	0.10
340.4583740	0.27
342.0674438	0.08
347.1245117	0.24
348.1287231	0.04
349.2228394	0.18
355.2441101	0.03
363.2898254	0.78
364.0567627	0.23
367.7105103	0.06
373.6777039	0.15
377.2377930	0.14
380.0170288	0.14
384.8065186	0.05
391.3494568	0.12
393.9017944	0.48
396.7933960	0.30
401.5669861	0.18
403.2176819	0.14
416.5022278	0.53
417.5174255	0.04
419.5547180	0.29
420.2419739	0.48
421.0750427	0.29
438.0305481	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3alpha,5beta,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
96.83468628	0.53
100.4141312	0.11
106.9589233	0.42
109.107254	0.79
111.0529327	1.11
113.0213394	3.11
115.0827255	0.57
116.9336243	0.47
118.7730865	0.24
120.9799728	2.64
123.1770096	0.23
125.0255051	0.16
129.0155945	2.84
131.0184326	2.11
132.75383	1.11
135.125885	4.80
136.961441	1.73
141.3591003	0.13
142.9975128	0.82
144.9619446	1.80
148.9977112	3.24
151.0108032	1.16
155.1842041	0.08
157.0471191	1.92
159.0599976	0.68
161.0115967	2.46
161.8803406	0.09
163.041748	2.84
164.4238892	0.16
165.2213745	0.52
167.0526733	0.32
168.8622742	1.59
171.0833282	1.58
173.1590576	2.08
175.0346832	0.43
177.2931824	0.23
179.0775452	0.79
180.987793	0.39
183.1006165	1.21
185.0641174	1.63
186.9919434	3.28
188.9581909	0.50
191.1668243	0.50
193.1703949	0.14
194.8230133	0.34
196.9502869	0.49
199.2155609	0.60
201.1133881	1.61
203.0473022	1.76
210.9720459	1.62
213.0608215	0.15
215.2162476	0.40
217.0270996	0.94
219.1195374	0.79
221.1075745	0.53
223.3162842	0.35
225.1539001	0.20
229.1371155	0.29
231.1564331	0.55
234.9766541	3.21
235.848114	0.18
238.8975525	0.14
243.3658447	0.16
245.3556213	0.80
247.2681274	11.40
249.1448364	0.29
250.984436	0.22
253.0392151	0.19
255.1893616	0.48
257.1981812	0.35
259.2089844	1.19
262.6829834	0.10
263.4272461	0.34
265.1813965	0.32
266.9876709	1.22
269.2859497	0.47
270.4416199	0.25
271.3197021	0.12
273.1622925	0.63
279.8867798	0.16
281.5567627	0.13
283.2528687	0.52
284.1656189	0.69
285.2249146	1.43
287.6010437	0.15
295.2794189	1.84
296.9927979	0.54
299.2374878	5.30
300.1044312	0.51
305.062561	1.77
305.7420044	0.24
312.6773987	1.07
313.5652161	0.75
319.4197998	0.07
323.2304993	100.00
324.2727051	0.76
325.0350342	0.64
332.7325134	0.22
341.4256897	1.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	226.002
Annotation	Unknow
Peak:m/z	Relative Intensity
70.0262527	0.04
73.8512421	0.31
75.8373642	0.28
87.9760361	0.03
90.0824127	0.01
101.9145508	0.58
104.8783417	0.07
119.8738708	17.19
121.6951141	0.15
136.9190216	9.16
149.9005127	0.05
151.8890839	100.00
161.9201355	0.24
166.8252716	0.04
179.8779144	0.30
183.8995819	3.30
184.9304199	0.04
191.0916138	0.02
192.6279144	0.12
206.7707214	0.09
208.0008545	1.39
208.7886200	18.54
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	293.1158
Annotation	N-gamma-Glutamyl-S-propylcysteine
Peak:m/z	Relative Intensity
85.0087433	0.04
86.8293533	0.19
88.0326996	0.09
88.9419708	0.93
101.8531342	0.11
104.8584595	0.77
105.9797211	0.51
106.8274994	4.57
117.8940964	0.36
118.9731293	0.12
120.1209793	1.56
124.3434906	0.05
130.0424500	0.37
131.7311401	0.20
133.0038910	0.09
135.9514771	0.70
142.3735962	0.04
146.9397278	17.47
148.1266479	13.13
149.0025940	92.20
150.0947266	2.36
152.0925293	0.19
156.1675262	0.06
160.6744080	0.11
161.2814636	0.36
162.1118317	0.21
163.9601898	18.22
165.1084747	13.93
165.9747620	100.00
169.1699066	0.06
170.1460876	0.48
171.0506897	0.21
172.1628418	0.65
174.1650696	0.16
182.3419037	0.10
187.1838379	0.06
196.9814758	0.06
204.9279175	1.62
206.0800781	7.55
206.9675293	0.12
208.4668274	0.17
209.1028748	0.05
211.3460083	0.11
215.0072327	0.10
217.1359253	0.33
221.2206726	0.11
223.4051514	0.09
229.8478088	0.07
231.2126770	0.41
232.0555115	1.79
233.0911255	0.13
234.2671814	0.11
235.2483826	0.12
237.3487549	0.21
239.3171692	0.15
248.2836914	0.14
249.2725525	1.03
250.1840515	0.06
253.2537842	0.07
258.0814819	0.12
259.1471558	0.42
262.4039307	0.21
271.4611206	0.29
272.8317261	0.23
277.1839600	4.74
278.1757202	6.63
286.0922852	0.33
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	683.2661
Annotation	Unknow
Peak:m/z	Relative Intensity
225.4094238	0.03
310.1878662	0.08
335.0515747	0.12
353.1809692	34.22
354.2666016	9.56
355.1011963	0.06
417.3035278	0.03
473.0731201	0.02
503.0773315	0.11
518.1347046	100.00
519.1990356	31.37
535.9444580	0.04
537.1778564	0.09
586.2211304	0.11
624.2700195	0.03
637.2540894	0.07
642.8031006	0.16
643.5271606	0.08
665.4871216	0.08
666.9751587	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	283.18
Annotation	Manilamine
Peak:m/z	Relative Intensity
88.87897491	0.05
92.81822968	0.06
97.01332092	0.04
107.0065002	0.06
108.9704971	0.10
109.8024597	0.02
110.9353943	0.03
111.8168488	0.15
112.9181595	0.23
121.9673615	0.01
123.0211334	0.02
125.2596741	0.15
126.0008392	0.37
127.1514053	0.02
133.1303101	0.10
133.9190826	0.03
134.9303284	0.02
138.1932678	0.03
151.3154755	0.03
152.0501404	0.26
154.1112061	0.21
162.0253601	0.29
166.798584	0.02
177.0652313	2.67
178.1305542	0.33
179.9829559	0.44
183.4249573	0.04
188.217392	0.04
193.9899597	0.01
194.7093506	0.06
196.0424805	1.43
197.2451172	0.13
201.1188354	0.05
205.1577759	5.67
206.7745361	0.16
211.1324463	0.02
213.1059875	0.12
216.9881897	0.20
220.0259705	0.21
221.2153931	4.45
223.1122742	38.35
224.0923157	9.09
230.1442871	0.04
235.0918274	0.02
236.2561035	0.02
237.0933533	0.05
239.2243347	1.22
241.1409912	1.20
243.1203003	0.03
247.3347168	0.24
248.1866455	1.04
249.0772705	0.04
253.4615479	0.01
255.1438599	0.09
259.7803345	0.05
261.106781	0.04
265.1650391	100.00
266.1909485	6.57
266.8068237	0.11
269.3841553	0.03
271.0063171	0.06
273.8859253	0.09
275.231842	0.16
294.8591614	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	378.08
Annotation	2'-Carboxy-4-[bis(2-chloroethyl)amino]-2-methylazobenzene
Peak:m/z	Relative Intensity
126.0341644	0.05
126.8398972	0.16
128.0643311	3.43
135.2359924	0.06
141.1604462	0.06
143.0408020	2.05
145.2227173	0.04
145.9145050	0.34
153.0180359	0.10
160.0846252	0.08
166.1379089	0.05
167.0996399	0.09
169.1974640	0.12
170.0456543	0.12
171.1146545	0.42
175.1594849	0.87
176.9954834	1.45
179.0665131	3.26
182.0132141	0.06
183.2763824	0.18
185.1377106	0.61
192.0305786	0.16
193.2407990	0.21
196.9244385	0.32
203.0308838	0.48
210.1500244	2.32
223.9825134	0.05
228.1882324	0.07
232.1716003	0.04
236.2074890	0.03
241.9826660	0.08
249.1048889	0.66
252.1775208	0.24
254.1217346	26.51
260.1619873	0.13
267.9061279	0.02
269.9771118	0.05
272.1314087	100.00
286.1129761	2.55
288.0902710	25.56
288.7337036	0.05
304.1527710	18.68
306.1577148	58.37
319.0012817	0.12
337.0512695	15.04
337.6830444	0.10
360.1593933	19.34
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	680.2076
Annotation	Unknow
Peak:m/z	Relative Intensity
191.9845886	0.04
221.0521240	0.15
232.9626160	0.01
245.1696320	0.01
248.7194977	0.06
250.5486603	0.06
251.2565765	0.01
277.1124878	0.05
279.9513245	0.03
323.2391663	1.15
337.2399902	0.04
338.2847900	0.13
341.2793579	0.59
348.3239746	0.06
352.3098145	0.02
383.3919067	0.06
411.0676880	0.02
447.9445801	0.09
471.3237305	0.01
477.2729492	0.05
503.2349243	100.00
503.8450928	0.35
518.0205688	0.07
590.3981323	0.11
591.6455688	0.04
622.1438599	2.76
639.1625977	11.53
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	178.0528
Annotation	Entadamide C
Peak:m/z	Relative Intensity
59.6063156	0.17
72.8770752	0.95
87.8588104	100.00
90.1011505	0.98
90.9501495	11.78
115.9127655	1.58
131.9288025	0.15
134.1079407	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	396.09
Annotation	Unknow
Peak:m/z	Relative Intensity
118.1838608	0.03
120.0650253	0.04
125.2487564	0.03
129.9566650	0.32
131.1596985	0.16
132.0141602	0.03
143.0430450	0.53
143.9623718	0.10
146.0717621	0.34
159.9919739	2.33
161.9141388	0.47
162.9627380	0.80
164.0225677	0.47
166.1446686	0.33
170.9282074	0.06
172.0758057	0.25
172.9012451	0.02
176.9522705	14.90
180.0316467	0.27
192.1394043	0.03
193.1119080	0.03
208.8617859	2.73
215.1307373	0.18
216.2346191	0.04
217.1749725	0.05
224.7898865	0.10
230.1642456	0.50
231.0266724	0.90
232.0839233	1.02
233.1395569	0.06
234.2385559	0.71
235.2790527	0.03
238.9440002	0.06
245.0058594	0.06
247.0606689	0.33
248.1186218	1.31
249.0826111	1.44
250.0185242	1.25
256.1113892	0.05
259.3552856	0.05
261.0071106	0.05
263.0792542	0.28
265.0786133	11.15
266.0825195	21.86
267.1537476	27.29
274.2848206	0.03
275.5241699	0.09
278.8943176	0.10
282.0853271	0.03
288.1195068	0.31
290.5623169	0.09
292.2630615	0.29
292.9475098	0.18
294.2073364	0.02
302.2525330	0.09
302.9200134	0.07
306.1224060	100.00
306.9617615	0.10
309.2847900	0.13
311.2045593	0.70
312.2039795	0.04
314.3454590	0.04
319.3002625	0.13
320.1369019	0.91
321.0618286	1.49
332.9826965	0.19
334.3578491	0.12
336.7329102	0.15
338.0628052	1.52
340.1914368	0.07
348.1489868	1.22
349.1393127	0.11
350.2359009	0.10
351.3120422	0.05
352.0294189	0.06
355.1311951	3.19
359.1119995	0.39
360.2007751	0.33
377.2320862	1.22
378.1734009	0.94
379.5106812	0.06
386.6295166	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	312.1294
Annotation	1,7-Dimethylguanosine
Peak:m/z	Relative Intensity
111.0829544	0.04
114.8970947	0.09
116.1199417	0.12
120.1389084	0.04
122.9055481	0.11
130.9518738	0.04
133.0283661	0.13
136.1004639	0.04
147.3090820	0.02
149.1059875	0.03
158.0297852	0.04
161.8325500	0.11
165.0775757	0.34
166.1036377	0.54
168.4282532	0.02
172.8085938	0.04
174.9387817	0.06
178.0245209	0.02
180.0096436	100.00
182.0162354	1.03
182.9938965	1.30
191.0984955	0.03
195.1221313	0.04
203.2156982	0.05
209.2168274	0.14
215.2749939	0.02
218.8892517	0.04
220.0751648	0.03
222.1177979	0.02
222.9129333	0.05
227.1014404	0.05
238.1190796	0.11
248.0375977	0.22
252.0665283	0.02
253.0392761	0.03
255.1712036	0.07
256.1549988	0.02
266.1035156	0.31
267.1154785	0.06
268.6836243	0.16
270.7667847	0.09
276.0826721	0.02
277.9809570	0.01
280.0158081	0.07
280.8945923	0.11
284.3648682	0.11
293.4307861	0.35
294.2295532	0.40
295.0802612	0.31
296.3273315	0.07
297.4958496	0.10
323.6751099	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	658.132
Annotation	Unknow
Peak:m/z	Relative Intensity
198.8499908	0.33
202.1255798	0.14
208.9925385	0.17
210.1818848	0.06
225.2516785	0.13
231.0272827	0.03
232.9880676	0.04
233.8810272	0.08
237.0343933	0.09
251.0245819	2.55
255.8735504	0.05
257.1195068	0.10
260.0960388	0.09
261.4867554	0.39
262.1579590	0.22
265.1378174	0.13
279.1064758	2.78
282.8004761	0.05
296.0157471	0.05
297.1089478	0.24
305.1430664	2.82
315.1881714	0.12
317.3498535	0.09
318.1239624	0.30
320.2747192	0.05
325.0086670	0.12
327.0508423	0.04
328.4916382	0.36
330.0906982	0.31
331.7518921	0.28
332.4393921	0.64
333.2553711	0.39
334.3453979	0.48
336.9459229	0.13
339.6047363	0.09
348.0728760	0.95
349.2610474	0.14
352.0663452	1.17
354.2341309	0.69
359.5974121	0.08
360.3332520	0.07
362.1859741	0.27
364.3068848	0.18
370.2149048	0.07
372.2678833	0.23
374.7965698	0.24
376.3694458	0.28
380.1284790	7.33
384.0727539	0.19
387.2391357	0.03
389.7983398	0.33
391.1024780	0.32
392.0844116	0.10
397.2898560	0.51
399.7222900	0.15
405.5320435	0.70
406.2432861	0.94
406.9484253	0.03
408.2860718	0.32
411.2481689	0.24
418.3219604	0.10
423.2125854	0.48
425.4986572	0.20
426.1522827	0.77
430.4099731	0.05
431.1817627	0.47
432.4578247	0.04
433.2795410	0.06
436.0905151	0.95
437.0544434	1.03
441.4696655	0.08
447.1725464	0.02
448.9551392	0.15
451.3997192	0.06
454.0415039	14.77
455.1270752	1.69
457.3419800	0.04
458.9502563	0.58
459.5824585	0.02
461.1452637	0.81
462.9167480	0.32
464.2064209	0.13
473.0447388	0.15
475.3890381	0.23
477.2496338	0.86
478.3254395	0.25
481.0797729	0.94
485.0660400	0.23
486.8851929	0.18
488.1694946	0.71
490.0419922	0.04
491.2650757	0.20
492.1404419	0.12
493.2334595	1.53
494.2443848	0.72
495.3784180	1.72
496.6424561	0.22
500.1997681	0.11
502.4183960	0.16
503.2914429	0.39
506.2454224	0.16
507.2729492	0.08
509.2781372	2.85
511.1115723	0.15
511.9586792	0.12
517.0783691	0.15
518.8573608	0.15
519.9727173	0.62
529.1095581	100.00
529.8058472	0.65
532.3051147	0.03
534.5203247	0.32
535.2721558	0.73
538.1655884	1.03
541.2514648	0.06
543.1780396	0.02
547.2551880	0.04
551.5004883	0.04
552.1657104	0.51
555.1746216	0.07
557.8586426	0.05
562.4002686	0.17
563.4011230	0.15
565.2175903	0.50
565.8184204	0.06
568.3687744	0.54
570.0956421	0.56
578.3765259	0.44
583.1746216	11.45
584.0372925	0.21
595.0283813	0.16
603.6973877	0.06
604.6593018	0.12
606.3717041	0.10
610.1613159	0.25
610.8706665	0.04
612.1848755	0.28
613.9478149	0.09
617.1513062	1.50
621.1341553	0.18
622.2230225	0.35
623.1219482	0.19
626.2917480	0.03
629.8522949	0.05
639.6084595	0.78
640.2470093	3.94
640.8866577	0.19
641.5073853	0.17
647.0765991	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	230.0842
Annotation	Unknow
Peak:m/z	Relative Intensity
73.0116272	0.05
77.1253815	0.05
83.8522186	0.04
86.1304169	0.04
93.0827637	0.02
99.9701843	0.01
111.8937683	0.03
126.8720551	0.03
133.2693787	0.03
134.1736298	0.01
135.2432098	0.07
136.1573639	0.02
140.0633392	0.71
152.7249908	0.04
153.7025146	0.04
155.0245972	0.01
155.9926605	0.05
166.0289001	100.00
166.8435059	0.01
170.0276642	0.05
171.4241333	0.04
172.0481567	0.09
176.1414642	0.02
179.8663788	0.02
181.1770935	0.06
182.2293243	0.02
183.9430389	0.40
186.1538849	2.25
187.9776764	0.29
188.6953583	0.17
189.4492035	0.03
193.1286316	0.12
194.1145477	0.04
197.4209595	0.08
198.7962646	0.08
200.2879639	0.03
202.0861816	0.05
207.2445984	0.14
208.0899048	0.09
211.0864716	0.07
212.1525726	1.23
213.0835876	0.70
221.2204742	0.05
229.9559326	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	328.1223
Annotation	Unknow
Peak:m/z	Relative Intensity
96.9452133	0.04
136.1305237	0.15
162.9902344	0.08
167.9170990	0.10
174.2518311	0.15
176.1349182	0.40
185.1708679	0.17
194.1395721	0.17
208.1139832	1.82
209.1799316	0.11
214.0903625	0.14
219.6826172	0.09
226.1768799	0.83
227.2055054	0.33
233.3415833	0.46
235.0031433	0.07
236.3133545	0.16
237.5669556	0.39
238.1672974	4.32
239.4980469	0.13
248.0212402	0.05
254.9974976	0.24
255.9673462	0.10
265.3471069	0.61
265.9649048	0.07
267.2736206	0.34
268.1171265	0.32
269.0697937	0.55
270.1221924	1.26
282.2306519	0.26
283.2035217	0.47
284.0551758	0.09
285.1410828	0.30
285.9724121	0.10
287.2234497	0.50
290.7830811	0.18
291.4650269	0.12
292.5069580	0.06
307.2229614	0.47
310.0234375	100.00
310.7354736	0.36
311.3955688	0.06
320.1588440	0.04
323.4257202	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	574.2299
Annotation	Ejap 14
Peak:m/z	Relative Intensity
178.8906708	0.10
184.1530151	0.18
185.0175781	0.36
194.9952545	0.28
197.2592163	0.09
197.9673920	0.07
199.9655762	0.57
213.0113373	0.05
225.4298706	0.35
228.2862396	0.27
238.2578125	0.05
239.1141968	0.16
239.7741394	0.12
242.1611328	1.62
242.8882141	0.07
256.1743164	0.29
259.1543579	0.53
260.3424377	0.11
264.0104675	0.14
266.1264038	0.15
267.3183594	0.26
268.9033813	0.18
271.1533203	0.89
281.1589661	2.14
282.0866699	0.64
283.5083008	2.08
284.2428894	12.36
289.2064209	0.37
300.3902588	0.09
308.4075012	0.09
309.1517944	0.35
310.0745544	1.57
311.0499878	2.02
313.0512390	40.01
314.1019287	6.42
315.0229492	0.19
315.6352844	0.11
324.1876831	0.11
325.1474609	0.15
327.2748413	0.77
329.2624512	0.11
336.2058105	0.33
344.3334351	1.50
345.2189941	0.15
352.3439941	0.24
353.1522217	0.07
354.1610718	0.19
355.3360596	0.37
356.2258911	0.21
370.4439697	0.05
371.2654419	1.03
375.9365234	0.10
377.9801636	0.23
380.6123047	0.06
382.2256470	2.00
383.4246216	0.46
388.1784058	0.16
395.3310547	2.89
396.3288574	0.40
398.0923462	0.15
400.0856934	2.07
400.6869507	0.21
412.3129883	6.42
413.3913574	1.91
414.2703247	0.24
418.1646729	2.52
423.1256714	0.23
424.1356812	0.50
425.0397339	0.12
426.1464233	0.32
427.3306274	0.15
428.4364624	0.22
429.2613525	0.18
435.5570068	0.07
438.3726807	3.84
439.5280151	0.36
440.4044800	0.07
441.2092285	1.00
442.1566162	3.87
443.1006470	1.83
444.1740723	2.24
445.2890015	2.91
454.2966919	0.08
456.2318115	18.38
458.3306274	0.05
462.3250122	0.09
464.3453369	0.79
465.3389282	0.19
468.2975464	0.13
469.1669922	0.17
471.3416748	0.20
480.0297241	0.08
482.2933350	12.25
483.3524170	0.53
486.4630737	0.13
500.3640747	100.00
511.1643677	0.29
512.5046997	0.52
513.5419312	0.24
514.4500732	0.38
515.3421631	0.13
519.4307251	0.17
527.0772095	0.15
528.2827759	0.10
529.3706055	0.47
530.6087036	0.66
532.3405151	1.92
537.2486572	2.43
538.3405151	0.63
539.2696533	0.52
540.4965210	0.13
555.2283325	11.68
556.2772827	23.08
557.2400513	2.53
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	438.1684
Annotation	Unknow
Peak:m/z	Relative Intensity
129.2409668	0.09
133.1835480	0.18
133.8707733	0.09
154.3212891	0.03
166.1028748	0.11
172.1123962	0.03
174.6687927	0.09
177.1116028	0.05
193.9065552	0.11
196.0484467	0.14
198.2346344	0.07
202.3305969	0.03
205.9380798	0.08
215.9812012	0.12
219.9897766	0.18
227.3094482	0.03
234.0531616	0.12
241.2613525	0.12
244.6246948	0.09
245.5597534	0.05
250.1452637	2.35
251.2033386	0.29
255.1756592	0.31
259.4717407	0.10
264.0736084	0.56
267.1145630	0.96
273.1237793	6.46
277.1460571	0.11
285.1415710	0.05
289.2313843	0.14
292.0639954	34.43
292.6714478	0.04
302.5939941	0.06
304.4395752	0.06
305.1654663	0.07
307.2755737	0.11
309.1075439	100.00
315.0266113	0.02
321.0738525	0.07
328.2287598	0.08
346.4501648	0.28
347.5940247	0.63
348.2048340	1.93
348.8895874	0.14
351.1685181	0.08
361.3101196	0.09
373.6413879	0.07
375.2405090	0.33
376.3829041	0.21
377.8399048	0.21
380.3847351	0.09
391.8563232	0.21
392.9313049	0.38
394.1138611	0.04
396.9144592	0.23
397.5337830	0.10
402.8015442	0.05
407.4337158	0.08
415.7996216	0.30
419.3701172	0.74
420.2592773	2.98
421.2919312	0.37
422.2671204	0.02
428.6354675	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	571.0256
Annotation	Unknow
Peak:m/z	Relative Intensity
245.0603943	0.16
245.8976440	0.06
247.1088104	0.09
266.1102295	0.10
282.9394531	0.09
288.0347900	0.05
311.0008545	1.60
339.4635620	0.11
376.2393188	0.24
380.3633423	0.20
383.2061157	0.05
391.4173584	0.16
395.2576904	0.08
421.0999756	0.08
423.0580444	0.10
432.5615234	0.25
441.2366943	0.12
442.1788330	0.23
465.2694092	0.14
468.4276733	0.06
469.1937256	0.10
470.1074219	0.24
475.6435547	0.06
479.4724731	0.08
483.0258179	0.31
484.4527588	0.07
486.5911255	0.08
491.2306519	0.16
492.4487915	0.14
496.9297485	0.67
497.8128052	0.30
504.8710327	0.11
506.8224487	0.19
509.1597290	0.09
525.0772095	100.00
526.6176147	0.15
528.9376831	0.06
531.2215576	0.08
535.2373657	0.12
535.8877563	0.03
540.4719238	0.15
541.3399658	0.12
543.5278931	0.09
550.7820435	0.05
552.1436768	0.45
552.8468628	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	309.12
Annotation	Unknow
Peak:m/z	Relative Intensity
90.9822159	0.87
92.3991852	0.09
96.8892059	0.50
102.9557266	0.48
109.1088257	0.06
109.8234863	0.02
110.8602295	0.37
116.2546997	0.31
116.9553070	0.10
119.9541473	21.82
126.8184433	0.46
128.4035339	1.73
129.0047302	6.92
130.9787292	0.30
139.9599609	0.17
143.9865112	0.63
144.9298096	0.73
146.2001953	0.57
146.8746948	4.96
148.9982300	1.17
151.1050873	0.09
155.1197205	0.08
157.0242157	0.05
158.1289673	0.22
160.8261108	0.14
162.0287170	0.62
162.9649658	0.24
164.8019104	3.66
165.9911194	100.00
170.2713623	0.43
171.0046387	0.38
180.0901947	0.05
184.2512970	0.03
185.0533295	0.08
188.6165466	0.35
193.2073822	0.45
195.4133759	0.18
201.0458374	0.27
202.0677795	0.27
203.3601379	0.23
205.9892883	0.11
209.1853638	0.36
211.1666565	0.09
212.2112122	0.21
216.8976440	0.27
220.1821594	0.06
225.0141907	1.05
227.0910339	0.05
228.3818970	0.89
230.8993835	0.13
232.0800781	0.45
235.1709595	0.46
236.0710449	1.00
236.9104919	0.56
237.5441589	0.12
238.1847534	0.25
242.8327026	2.26
247.0576172	0.45
248.7821045	0.60
250.0223999	0.13
252.1166382	0.09
253.5329590	2.04
254.1757202	1.82
254.8414307	5.75
255.5155640	0.16
257.1853638	0.40
258.9603577	0.03
260.9431152	0.23
263.0929565	0.57
264.0909729	0.87
265.2147522	2.64
266.4738770	0.32
268.1744385	0.08
270.9728394	0.35
272.2433472	1.88
272.9329529	6.19
274.3748779	0.13
275.1812134	0.41
278.1434937	0.16
279.9737549	0.19
281.3270264	0.55
290.1732483	0.49
291.1596069	3.32
292.2254028	7.92
299.6456299	1.40
300.2697754	0.32
304.1722412	0.21
310.4120178	0.05
317.3272705	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	460.022
Annotation	Unknow
Peak:m/z	Relative Intensity
134.2926636	0.14
153.1238556	0.30
158.0433960	1.88
160.1668243	0.15
169.2458801	0.28
176.8575134	0.26
178.0743866	0.20
180.2477417	0.23
183.0064697	0.48
184.0775146	0.07
189.8257141	1.52
194.9484558	0.33
196.9611816	0.32
201.0915222	0.49
206.0911407	0.50
210.5859375	0.58
222.1339111	0.93
223.6849976	0.47
224.3439636	0.21
235.2965546	0.15
237.8171387	0.12
240.3028717	0.36
248.2121887	0.11
250.3047180	0.39
258.0569153	0.31
262.0172119	0.14
264.0230408	4.74
265.1610718	0.08
266.2061768	0.05
267.3812561	0.20
275.2423706	0.30
282.4779663	0.11
283.3362427	0.05
285.0168152	0.10
295.9320679	12.35
300.6250000	0.14
309.3193665	0.64
311.4654541	0.04
312.6013794	0.12
314.4139404	0.15
319.2955627	0.30
326.0892029	0.07
326.7515869	0.58
327.9113159	0.33
328.8072510	0.27
337.2536926	0.07
343.4838257	0.20
345.1697083	0.25
350.2840271	0.23
353.0379639	0.85
353.9718628	2.21
355.0353394	0.43
365.2994690	0.09
369.9123535	100.00
370.5216064	0.97
383.1210022	0.14
385.9393616	1.99
387.2154236	0.10
388.3318787	0.18
388.9531555	0.13
390.1761780	0.27
391.9217224	0.30
395.3523254	0.21
396.6325989	1.17
402.1139832	1.30
410.8226624	1.08
412.2183228	0.11
415.2436829	1.08
418.4307556	0.10
419.8583069	0.24
424.6538391	6.98
425.4722595	0.54
427.8549500	0.09
440.7220764	0.40
441.4349365	1.98
442.2160339	2.20
443.3147583	0.20
450.9186096	0.27
533.4611206	0.14
599.1295776	0.08
692.3262939	0.26
717.3516846	0.10
719.5919800	0.14
754.3535767	0.26
790.6896362	0.33
884.0558472	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	564.3304
Annotation	Unknow
Peak:m/z	Relative Intensity
255.3051605	0.01
279.2478638	1.65
300.0401001	0.04
362.4405518	0.05
459.3529053	0.03
500.4658813	0.07
504.3432617	100.00
505.1181030	0.57
518.2095337	0.19
545.7127075	0.13
546.5192871	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	369.0829
Annotation	Isoferulic acid 3-O-glucuronide
Peak:m/z	Relative Intensity
110.8806763	1.98
114.7782898	0.07
119.1424484	0.34
125.0836258	0.07
128.0279846	0.14
129.0043030	7.64
142.1376038	0.38
145.1054382	0.08
155.2127228	0.09
159.0268860	0.16
161.0109558	0.60
161.7084961	0.17
162.9886322	0.59
165.0130768	0.08
173.0468445	0.13
175.0054932	0.11
179.2333679	0.30
187.0038147	1.04
188.1010132	0.19
205.0666351	36.88
207.3866577	0.11
209.2146759	0.10
223.0362549	100.00
232.4226990	0.23
247.1993103	0.17
251.2475586	0.18
269.7927856	0.19
273.0704651	0.27
295.4210205	0.25
307.1979370	0.22
309.3571777	0.04
311.1299438	0.15
323.2280273	7.59
324.1253662	0.05
325.2288818	0.84
332.9534912	0.32
345.5176392	0.07
350.5762024	0.75
351.2140198	1.97
369.2117615	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1089
Annotation	5-O-(alpha-Mannosyl)-myo-inositol
Peak:m/z	Relative Intensity
96.92657471	0.17
98.95713043	0.69
100.9980469	3.33
112.9783478	21.50
118.9883881	14.10
124.9910431	1.74
126.869133	0.29
130.8998871	6.75
143.0491638	21.28
149.1136475	6.01
161.0076752	20.78
175.983078	0.33
179.048584	100.00
198.1763	0.47
232.3069458	0.25
235.2006531	0.13
241.946228	0.35
250.3120422	0.49
279.1339417	0.17
280.0528259	1.59
281.1971436	1.31
295.3372803	0.61
300.3248291	0.55
322.0872803	0.12
323.151123	0.52
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	315.2541
Annotation	12,18-dihydroxystearic acid
Peak:m/z	Relative Intensity
92.99550629	0.38
104.4653778	0.61
105.1247711	0.43
119.9008789	0.78
128.7131653	0.45
153.0006104	0.36
159.1976318	0.49
162.9945831	0.82
167.1606445	0.87
182.7583008	1.01
189.170929	0.96
195.0586548	0.54
211.0841675	0.65
213.2494812	0.41
215.9159546	0.59
219.1797485	0.46
221.4446106	1.87
225.1821899	3.21
241.2185974	4.94
243.1112366	2.27
249.3422241	0.59
253.3033142	83.26
255.4012146	2.10
270.6362	3.15
271.2737732	5.63
273.1100464	0.54
274.0339966	1.12
279.1409302	1.11
281.3817444	1.51
283.174408	1.56
285.24646	0.54
295.1505127	0.31
297.2467651	100.00
298.1766357	0.36
299.3282471	0.25
300.0729065	1.20
301.1861877	1.99
313.4222717	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	563.18
Annotation	Unknow
Peak:m/z	Relative Intensity
161.8959656	0.71
173.9389343	0.07
196.9840088	0.14
201.9836426	0.18
213.1167603	0.04
214.1415558	0.40
226.1424255	0.10
229.2288818	0.05
230.6364288	0.17
239.0179443	0.30
243.1236572	0.04
245.2198334	0.16
246.1767273	0.13
255.1509857	0.21
256.1001587	2.49
257.2404480	0.12
262.1495361	0.10
269.0647278	0.07
271.0892944	0.38
273.1108398	2.98
274.1604309	0.29
291.1706543	5.47
303.2077637	2.52
310.2390747	0.08
313.2844543	0.14
315.8736572	0.03
323.6892090	0.14
330.0993042	0.32
345.1832275	0.46
357.2826538	0.22
359.0800781	0.08
363.9379272	0.04
367.2281494	0.08
371.1077881	0.50
375.2666626	0.13
380.2262573	0.06
381.0216064	0.29
382.8259888	0.29
384.2081299	0.38
386.1157227	0.19
387.3099976	0.22
388.1482544	0.16
389.1229248	1.37
392.0443726	0.32
393.3421631	0.08
397.2395020	0.18
398.1711426	0.14
399.1875610	1.95
400.1956787	0.32
401.3231812	0.24
402.3134766	0.46
416.5893555	2.42
417.2153931	9.43
420.0104370	0.10
422.8856812	0.31
434.1538696	100.00
434.7611084	0.56
443.3975220	0.16
444.1166382	0.46
445.2595215	0.09
446.7803345	0.15
452.9921265	0.44
454.2042236	0.36
458.0289307	0.08
463.0307007	0.13
471.2667847	0.28
472.0196533	0.17
473.1872559	0.75
473.8527222	0.21
491.5309448	0.09
500.0996094	1.57
503.9104614	0.18
517.2719116	0.68
518.8956909	0.07
522.1932373	0.47
527.2091675	0.23
540.4149780	0.47
542.9740601	0.04
544.3488159	0.61
545.2960815	3.47
546.2735596	0.21
547.7716675	0.24
555.9693604	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	753.2307
Annotation	Unknow
Peak:m/z	Relative Intensity
250.6541443	0.03
323.3142700	0.03
340.9660034	0.14
383.2107544	0.03
413.0339966	0.08
442.0220337	0.04
442.8814697	0.15
503.4260864	0.07
605.2839966	0.01
665.2922974	100.00
666.4718018	0.13
667.4252930	0.50
668.6499634	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	322.09
Annotation	Unknow
Peak:m/z	Relative Intensity
112.1157379	0.07
116.0684357	0.09
117.8309021	0.37
119.2739716	0.09
121.9209061	0.09
143.2504272	0.06
148.9893494	0.38
153.1726685	0.22
159.1116943	0.59
159.9098816	0.15
163.9237213	0.07
170.1144409	0.15
171.9562073	0.30
174.0047302	0.21
175.3330841	0.17
177.0408173	0.10
177.9194794	1.50
182.2988586	0.10
182.9939117	0.20
185.3468933	0.08
190.7144165	0.81
192.5696411	0.50
193.3241882	0.39
196.2444763	0.42
209.1417847	0.70
211.9768372	0.28
213.9574280	3.62
232.0401001	100.00
233.3448181	0.20
241.3790894	0.15
242.2733459	0.08
244.3062744	0.16
245.1800232	0.17
251.2722473	0.14
252.0480957	0.12
258.0548401	0.14
260.1087036	0.55
262.1701965	0.19
263.0825500	0.04
264.2134705	1.16
267.4071350	0.19
268.8984985	0.12
274.2492371	0.12
276.0585327	1.05
276.6841431	0.32
278.9721680	0.07
280.4677124	0.52
281.1467285	0.08
285.3810425	1.26
286.1342163	0.82
290.2131958	0.16
292.0691833	0.73
293.7873230	0.15
301.3806152	0.81
303.9342651	12.65
305.0775146	0.43
312.5731506	0.67
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	307.095
Annotation	gamma-Glutamyl-S-(1-propenyl)cysteine sulfoxide
Peak:m/z	Relative Intensity
87.8184433	0.23
89.7195206	0.01
120.0498352	0.03
129.9351807	2.99
143.0282593	0.05
154.0956116	0.09
160.1204224	0.59
161.1131897	0.04
176.1157532	0.02
178.0331116	10.32
189.5612488	0.08
190.1659851	0.04
191.0194855	0.02
198.9849548	0.42
200.3364868	0.11
203.3074036	0.06
207.8238831	0.04
210.9359131	0.02
217.0162659	100.00
219.0576477	0.04
220.1317139	0.06
229.3424377	0.04
235.3028564	0.14
242.8125000	0.04
244.0605469	0.25
248.9346313	0.02
259.3134155	0.12
263.0159302	0.16
265.1716309	0.06
265.8583679	0.21
269.6929626	0.16
271.0449219	0.05
288.2722473	0.24
289.1458740	1.07
292.9537659	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	654.2451
Annotation	Unknow
Peak:m/z	Relative Intensity
242.9470215	0.06
247.4845581	0.11
251.1282043	0.05
299.1519165	0.15
314.1422119	0.05
324.0609131	0.22
331.2881470	0.03
338.5151978	0.05
348.0420532	0.07
360.3983154	0.06
361.2160034	0.05
377.3340454	0.79
378.1812744	0.27
395.2842407	92.15
404.4060059	0.08
431.2817383	0.32
435.1970215	0.15
449.3922729	0.85
453.2014771	0.17
458.2172852	0.07
478.3212280	0.35
489.2471924	0.07
496.2810059	0.13
497.3288574	0.11
506.2205200	12.36
507.3054199	5.01
508.2247925	0.09
524.2526855	100.00
525.3582153	6.72
539.1790161	0.04
546.2482910	0.05
561.2160645	0.28
564.1970215	0.18
573.5612183	0.06
579.3767700	3.45
594.0921631	0.05
601.1000977	0.12
618.2892456	0.61
635.8308716	0.51
636.4386597	11.00
638.4794312	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	328.1189
Annotation	1-O-Acetyllycorine
Peak:m/z	Relative Intensity
96.9040680	0.02
106.9744415	0.03
117.0626221	0.01
133.9519806	0.05
135.0359192	0.85
136.8933105	0.01
149.1499939	0.04
160.9302826	0.09
162.7526855	0.06
163.4105835	0.04
164.3029938	0.03
166.0647888	0.01
173.1265259	0.03
178.1107178	0.02
196.2615356	0.01
199.9077759	0.04
205.8390350	0.02
207.3365173	0.01
208.1380005	0.03
228.2956848	0.05
232.9190063	0.02
234.1430969	1.58
235.0035706	0.01
239.2151184	0.20
240.1427917	0.03
244.4322815	0.05
253.1683960	0.03
255.9019775	0.06
263.1275635	0.09
265.1858521	0.05
266.0932007	0.03
281.6929016	0.18
282.4055176	0.10
283.3807373	0.19
284.1845703	0.13
285.2020569	0.14
292.3334656	0.02
293.0877075	0.02
295.0907288	0.03
310.1619263	100.00
311.0164490	0.10
312.3483276	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	494.091
Annotation	Unknow
Peak:m/z	Relative Intensity
142.8460388	0.06
167.1831512	0.11
170.0432129	0.04
176.1865082	0.09
193.9937134	0.05
208.2164612	0.09
243.1690674	0.06
244.2445679	0.34
247.2078552	0.05
254.1377258	0.31
266.2208862	0.11
268.1724243	0.27
272.2015991	1.73
280.1896973	0.25
282.0630188	0.41
283.4106445	0.15
286.0356140	0.30
288.0318298	1.29
289.3813782	0.07
290.1830750	0.34
295.5899048	0.07
301.2287903	0.29
304.2604675	0.07
306.2800293	0.28
312.1925049	0.12
313.2268677	0.93
314.1706238	2.17
315.1436462	0.12
317.2847595	0.17
324.4136963	0.49
327.3566284	0.46
328.2391357	0.18
331.3767395	0.52
333.2558594	2.26
334.2249756	0.28
335.2982178	0.40
335.9118652	0.07
336.9594727	0.13
342.2987976	1.60
343.2941284	0.31
345.4894104	0.09
347.3693237	0.61
349.3703308	0.15
352.0576172	3.45
360.2232361	0.21
368.4479980	0.19
370.2176208	5.11
373.3699341	0.07
374.1151123	0.53
375.8441772	0.84
376.6298828	0.09
378.2125549	7.78
379.5642090	0.12
383.9918213	0.36
385.2279968	0.19
386.2914734	0.99
388.1706848	6.40
395.4414978	0.10
400.7682190	0.07
402.3481750	0.22
404.1757202	1.10
406.3341980	0.14
407.3191833	0.53
417.2874756	0.49
419.2396240	0.40
420.3230286	1.99
422.3130188	2.67
425.8526001	0.76
429.3945312	0.34
432.7071838	0.26
433.9251404	0.45
435.0852051	1.78
436.0406494	0.15
440.0675659	0.80
440.6852417	0.06
447.3166809	0.61
448.1383362	1.01
449.3905334	0.34
452.1082458	0.18
453.2351379	8.60
458.1045227	34.38
458.7239685	0.49
470.4041138	0.11
473.4013062	0.10
474.3312378	0.07
476.1076965	100.00
485.5099182	0.33
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	425.1914
Annotation	PG(6:0/6:0)
Peak:m/z	Relative Intensity
120.1354218	0.01
124.0960388	0.01
125.9817963	0.05
130.1035309	0.02
137.1851044	0.04
140.0115662	0.01
144.9517822	0.03
147.1153107	0.03
147.9017487	0.01
162.1556244	0.01
163.1933289	0.01
164.1227875	0.05
165.1898499	0.04
171.1308899	0.01
171.9694214	0.01
173.0595703	0.01
176.2751617	0.04
177.1151428	0.01
178.0254974	0.01
187.1863861	0.01
189.2151184	0.01
190.1199341	0.31
190.9708405	0.02
192.0392914	0.03
193.1930237	0.02
194.1891632	0.02
200.3404846	0.01
202.2103271	0.09
204.3420868	0.06
206.1910400	0.08
214.6690979	0.04
215.2730255	0.03
216.2127686	0.08
217.3727112	0.02
218.4342346	0.05
219.3556824	0.15
220.3482513	0.07
222.1778259	0.07
224.2634430	0.03
226.0180969	0.02
228.1950378	0.01
229.1544495	0.05
230.1304169	0.08
231.1820374	0.52
232.2876587	0.04
233.1450195	0.07
246.1635132	0.05
247.3951416	0.01
250.2750244	0.09
255.2179871	0.02
257.0633240	0.03
258.1925354	0.38
259.2294006	0.04
260.2539062	0.13
263.1428223	0.35
264.2467346	0.41
267.0936279	0.01
271.2871399	0.04
272.2760620	0.04
273.2644348	0.12
274.3428345	0.04
275.2718201	1.22
276.1386108	0.04
277.2903442	0.08
278.1233521	0.04
279.3885498	0.13
283.4818726	0.01
284.2362976	0.04
285.4641724	0.06
291.1639099	0.15
292.3991394	0.03
293.2840576	0.43
294.0086975	0.01
295.3651123	0.03
296.3222961	0.08
298.1817017	0.04
301.2944336	0.09
302.1838684	0.02
304.0000916	0.03
307.1915283	0.09
308.3176270	0.02
309.4742432	0.02
311.2406006	0.24
312.3639832	0.06
313.2612000	0.05
314.3224487	0.02
315.3067017	0.04
316.5822754	0.12
317.6580200	0.06
319.2586060	100.00
320.3181152	3.55
321.3495178	0.01
322.2557983	0.05
323.3162231	0.07
325.4139404	0.01
327.3168640	0.04
333.3487854	0.13
335.3122864	0.10
337.2376709	0.11
338.1865845	0.02
339.0970459	0.01
340.5078430	0.02
343.4476624	0.02
349.5328369	0.03
350.7285461	0.67
351.3562927	8.77
353.3218689	0.46
356.9486694	0.01
358.3359375	0.43
359.2831116	0.21
360.3618774	0.11
363.7076416	0.08
364.3420715	0.00
369.1028748	0.10
378.2364502	0.02
379.2033691	0.07
381.2329102	14.92
381.8477783	0.04
382.6243896	0.01
383.2383118	0.04
384.2167053	0.73
391.4062805	0.02
393.7719727	0.02
397.1593933	0.04
402.8752747	0.01
406.5120239	0.08
407.3080139	0.25
408.2620544	0.01
409.2138367	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	464.1561
Annotation	Unknow
Peak:m/z	Relative Intensity
137.0161743	26.26
147.0887604	2.91
155.1216431	0.19
164.1005402	21.60
175.1469421	0.08
179.1867065	0.35
183.9516907	0.10
194.7419434	0.39
197.0554199	0.05
228.1174316	0.12
238.0689240	0.11
238.9416504	0.11
240.1672974	0.38
249.2246094	0.09
257.0433960	0.51
259.3009644	0.35
264.2092896	0.17
271.9752502	1.47
283.1804810	0.18
284.2359009	0.46
290.3129883	0.27
299.1438599	100.00
301.2897644	0.17
304.2791443	0.14
306.3530579	0.09
316.0532837	2.73
321.1320190	0.14
325.8957214	0.10
330.4596863	0.42
333.2224121	0.12
335.2586670	0.12
340.6006775	0.11
344.3139954	0.16
348.0423279	1.41
350.0703125	0.79
362.2713318	0.41
364.7380676	0.15
373.8788757	1.53
374.4864197	1.00
380.2485657	2.25
388.2591248	0.19
402.4589539	0.22
403.0719299	0.13
405.9932556	11.06
406.6981812	0.07
417.9707642	1.05
419.3871460	0.15
422.4506836	0.23
423.1189270	8.11
428.2966614	0.26
429.3511047	0.26
445.9782104	2.72
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	354.0778
Annotation	Unknow
Peak:m/z	Relative Intensity
102.8757477	0.02
112.0829086	0.11
121.9941254	0.45
130.0359344	1.65
130.8441010	0.03
151.2480621	0.01
153.1203918	0.09
158.9470215	0.07
160.1000061	0.09
170.1764526	0.06
177.0417786	6.68
177.9387970	0.01
196.7556305	0.03
207.9716949	11.13
225.0808105	100.00
238.7610474	0.07
241.1608276	0.02
250.6310425	0.10
261.0817566	0.50
263.2431335	0.05
265.2669678	0.04
271.2667542	0.09
279.0692139	9.36
288.1909485	0.04
291.1360474	0.41
306.3609619	0.18
307.4642944	0.01
308.2797241	0.05
318.4546509	0.14
323.1478882	0.05
325.9706116	0.08
336.0936279	1.69
337.0584412	0.63
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	277.14
Annotation	Saccharopine
Peak:m/z	Relative Intensity
82.0736160	0.11
83.9568329	0.41
88.0343628	0.12
97.8934021	0.32
101.9136810	11.41
105.0454712	0.14
115.9147491	1.60
121.9509659	1.08
127.9032669	0.22
129.9073486	0.28
130.8631897	0.61
134.1025085	0.28
137.1385498	0.32
137.9904175	0.08
148.0030823	100.00
155.9887848	5.43
158.1198730	0.03
164.8073120	0.06
170.0346680	0.17
174.0617523	0.04
177.0400696	0.30
182.0914307	0.18
186.9580688	0.92
189.8818970	0.50
198.9915466	0.34
200.6952820	0.24
204.9138794	0.09
209.3560486	0.04
212.2178955	0.16
213.9133301	1.14
214.5195923	0.07
215.4397888	0.16
217.8325195	0.05
220.4620056	0.03
228.1205444	0.03
229.0105591	0.21
230.9540100	2.37
231.9446716	0.40
232.9621277	0.20
234.0164490	0.24
235.2375793	4.37
241.0522156	0.14
245.1178589	0.42
249.0873413	0.20
255.9971313	0.03
259.0853271	4.16
260.0657349	5.87
260.8669739	0.32
269.1702881	0.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	624.386
Annotation	PS(12:0/12:0)
Peak:m/z	Relative Intensity
201.1735687	0.13
222.9017792	0.12
227.1187286	1.12
266.0754700	0.15
279.4034119	0.10
280.2693176	0.22
282.3042297	0.50
283.5527344	0.53
307.0017700	0.38
313.3985291	0.37
317.8536987	0.24
325.4538574	0.42
347.3668213	0.27
353.4923096	0.21
355.1856689	0.18
357.5028687	0.26
368.1310425	0.91
369.5875854	0.18
393.3759155	0.22
415.0343018	0.07
436.4157715	0.15
453.8225708	0.19
454.5092163	0.21
458.2485962	0.14
483.3807983	100.00
484.0379639	0.42
487.6648560	0.39
489.6016235	0.24
491.3843994	0.12
508.2604370	0.31
524.9113159	0.58
534.4547729	0.57
563.0776367	0.29
567.4232788	0.40
578.4276733	0.17
581.1983643	0.25
588.3408813	0.25
589.2534790	0.19
592.9042358	0.14
605.3106079	0.38
606.8554077	0.77
607.5361328	0.82
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	178.0529
Annotation	Entadamide C
Peak:m/z	Relative Intensity
69.8643341	0.50
72.9172897	0.75
87.8637848	100.00
88.5976486	0.04
90.9014740	0.53
91.6043930	0.02
107.9040527	0.20
114.0257721	3.94
114.9760590	0.14
116.1605530	0.10
117.7581482	0.12
119.8975525	0.44
124.9448547	0.15
131.9297638	1.68
135.8157806	0.82
141.9195404	0.03
142.9294891	1.50
159.9505920	22.97
160.9791412	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	639.1568
Annotation	Nervilifordin C
Peak:m/z	Relative Intensity
178.9800873	0.15
184.8267212	0.03
191.1318054	0.10
192.1518860	0.03
196.0769958	0.05
201.1556091	0.12
202.8559723	0.06
204.1740417	0.15
205.2686768	0.12
206.3296814	0.03
214.2769623	0.03
215.4117432	0.14
219.0771484	0.04
221.2029419	0.02
225.9922791	0.07
227.0931091	0.04
228.1751404	0.05
232.2161713	0.03
233.1476746	0.12
234.3176575	0.06
241.1793213	0.06
242.2777405	0.31
243.2058411	0.19
244.2677765	0.21
245.3681641	0.04
246.2413635	0.03
254.2854614	0.35
255.0352173	0.62
256.2839355	0.44
257.1331787	0.06
259.1594849	0.07
260.3300171	0.03
269.1940002	0.06
270.2869873	0.59
271.1599426	1.82
272.2023315	0.71
273.1007690	0.24
274.2790222	0.14
275.0482178	0.28
283.1495056	0.14
284.3156128	0.64
285.2323914	0.93
286.0570679	0.34
287.1748657	1.30
288.2116089	0.25
289.2085266	0.10
292.2577820	0.02
297.1242676	0.14
298.1799316	0.29
299.1386108	1.02
300.1585083	6.90
301.1721191	1.76
302.2227173	0.06
305.2268066	0.05
307.0966492	0.09
309.9709473	0.09
310.8881226	0.40
313.1197205	17.37
314.2956543	12.67
315.1363525	100.00
316.2257996	19.30
317.1479492	0.31
323.2379150	0.03
325.1164551	0.60
326.2999268	0.11
328.1854858	0.46
329.2804565	1.21
330.2714844	0.17
338.3247681	0.04
339.0169067	0.24
339.9066772	0.06
342.2362061	0.07
343.2905273	0.06
343.9515991	0.09
350.2510986	0.03
354.0693359	0.10
355.1051636	0.13
356.5393677	0.59
357.1705322	4.47
358.1896362	1.19
365.1100464	0.08
369.1296387	0.06
370.2625122	0.07
371.0401611	0.04
381.3197021	0.11
386.1654663	0.09
387.1505127	0.26
392.2924805	0.11
399.4000854	0.17
400.0769043	0.45
401.2369995	0.07
403.1900024	0.04
406.3802490	0.03
409.3008423	0.04
410.0775146	0.05
417.1289062	0.05
419.3436890	0.14
421.3495483	0.06
433.2159424	0.05
435.4201050	0.19
444.3031006	0.03
445.3617554	0.15
447.5457153	0.28
449.3162842	0.96
451.3973999	0.07
459.1431274	0.52
459.8295898	0.14
460.5093994	0.05
461.1429443	0.13
462.5159912	0.06
468.3518677	0.03
476.2182007	23.71
477.2133179	58.85
478.2632446	16.43
479.3170166	0.17
485.4982300	0.25
488.6032104	0.05
491.2423096	0.67
492.3890381	0.16
493.4628296	0.07
499.4099731	0.13
500.4375000	0.06
503.2712402	0.17
504.4711304	0.04
505.4270020	0.04
519.2135620	6.78
520.3098755	3.62
524.5970459	1.08
525.4828491	1.07
533.4358521	0.13
538.6428833	0.12
540.1204224	0.06
546.1522827	0.04
549.3488159	1.07
550.4385376	0.59
557.7402954	0.04
558.5208130	0.07
561.4057007	0.13
562.2515259	0.04
565.8669434	0.06
571.3071899	0.03
572.2675171	0.07
575.3747559	0.17
577.6460571	0.22
578.5394897	0.03
580.8598022	0.14
581.8762207	0.04
590.7219849	0.10
593.5120239	0.08
594.4566040	0.17
595.2567139	0.41
596.5187378	0.11
597.2432251	0.03
598.3344116	0.39
599.2762451	0.55
604.2553711	0.11
611.2917480	6.83
612.3298950	2.17
613.2379761	0.14
621.3389282	0.20
622.4956665	0.59
625.3825073	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	609.1698
Annotation	Unknow
Peak:m/z	Relative Intensity
186.9725800	0.06
192.1495056	0.01
196.1567383	0.01
198.9825134	0.02
209.9757996	0.05
213.1160736	0.05
219.2173767	0.02
226.2374573	0.04
227.3868866	0.02
228.1260376	0.02
229.0116272	0.16
230.2252197	0.05
231.2700806	0.02
232.9376831	0.17
245.1661987	0.09
249.1056061	0.03
255.4866028	0.01
261.1745300	0.03
262.9080811	0.09
264.0700073	0.08
268.1997070	0.04
268.9005127	0.04
273.0758362	0.37
279.2428589	0.20
281.4992981	0.06
283.0600281	0.02
288.8374023	0.08
296.2517700	0.01
299.9581909	0.15
301.2943726	0.03
302.6268311	0.01
303.3341064	0.03
304.2186279	0.01
308.2669678	0.05
314.8607788	0.06
316.6203918	0.07
317.7671509	0.05
319.0834961	0.06
320.8484192	0.02
323.9713135	0.01
328.0779419	0.01
331.9716797	0.73
336.1741333	0.14
338.2055664	0.04
342.0254517	0.44
343.0536499	0.01
350.2470093	0.08
353.1517944	0.02
360.4384766	0.05
362.3361206	0.03
364.1496582	0.10
374.1558838	0.69
378.3800659	0.04
379.1538696	0.02
390.1176758	0.87
392.2377930	0.04
393.3098755	0.02
400.3074341	0.13
401.3588257	0.05
404.4473267	0.15
405.1472778	0.07
408.3820801	0.05
411.2449341	0.27
419.2794189	0.02
422.1246338	0.54
426.3969727	0.04
429.1936035	5.49
432.1563721	0.38
437.6201172	0.06
442.2465210	0.04
443.3798218	0.06
444.5631714	0.04
446.1835938	0.09
447.2986450	0.19
449.4169312	0.02
450.0923462	0.03
455.4421387	0.05
461.2286987	4.77
462.3463135	0.02
463.4024658	0.02
465.2035522	0.03
471.3823242	0.07
475.5440674	0.13
476.2150269	0.05
478.0354614	0.31
480.0686035	0.78
485.2667236	0.05
486.2651367	0.02
487.0018311	0.03
488.0719604	0.11
489.8630981	0.05
492.8688965	0.68
493.6256714	0.19
500.9684448	0.46
502.3529663	0.08
506.3632202	0.06
510.3057251	0.16
515.0702515	0.04
519.1201172	100.00
519.7650146	0.50
533.2828979	0.31
534.2218018	0.03
545.2662964	0.02
547.1493530	0.02
551.1311646	10.35
551.8436279	0.03
554.8654785	0.02
563.3217163	0.13
567.6171265	0.35
568.2354736	4.02
573.4772949	0.15
586.2954712	0.06
590.1437988	0.38
591.1245728	0.34
591.8461914	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	639.1564
Annotation	Nervilifordin C
Peak:m/z	Relative Intensity
192.0178528	0.09
197.0757141	0.04
200.2401581	0.04
203.2322845	0.04
211.2002563	0.01
215.0151062	0.02
226.1019135	0.05
227.1492310	0.30
227.8853302	0.18
239.0699158	0.04
239.9588318	0.05
241.3211975	0.06
243.1682892	0.69
244.1658325	0.46
245.2321472	0.03
246.0330200	0.02
254.0823669	0.14
255.1204529	1.94
256.1463013	0.32
259.1614380	0.17
261.2309265	0.04
263.0386353	0.01
267.0216675	0.04
271.1398315	5.43
272.1728821	1.75
273.3121338	0.12
280.2509766	0.05
282.3076172	0.04
284.0434570	0.16
285.2412415	0.14
287.2931213	0.55
288.0836792	0.21
290.0109558	0.02
293.5778809	0.03
298.0711975	0.08
300.0733643	16.76
301.1759644	3.61
301.8833008	0.11
304.6017456	0.02
311.0578308	0.05
312.8344727	0.17
315.1447754	100.00
316.1293335	23.19
316.7518005	0.02
322.9835205	0.10
325.9841919	0.02
327.9243164	0.03
329.1665039	0.49
330.2444458	0.12
332.3159180	0.01
342.1551514	0.13
354.4165039	0.06
356.0979614	0.09
357.1735840	0.94
358.1451416	0.04
367.1365356	0.06
369.2855225	0.09
373.3251343	0.08
374.1328125	0.08
381.0577393	0.02
385.9762573	0.02
393.2451782	0.02
399.2476196	0.03
413.4304199	0.01
423.4463501	0.05
457.6113892	0.02
459.1162720	0.45
460.3636475	0.04
467.2397461	0.01
473.3131714	0.13
474.2802124	0.07
475.2970581	0.02
477.3583984	0.21
478.3143921	0.08
500.2326050	0.03
506.0070801	0.02
507.2756958	0.04
516.3602905	0.14
524.2671509	0.12
526.3392944	0.05
534.4669189	0.04
535.0775757	0.04
549.2567749	0.01
552.4587402	0.06
553.4520264	0.03
554.2373657	0.01
579.4723511	0.02
588.5036011	0.04
593.2589111	0.08
594.4933472	0.07
595.6287842	0.12
596.3900146	0.05
599.3242798	0.04
604.4169922	0.01
606.2127075	0.01
607.1900024	0.28
608.2533569	0.11
609.6775513	0.03
610.3906250	0.02
611.2549438	0.42
612.2708740	0.06
621.5004272	0.07
622.4332886	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	357.0131
Annotation	Unknow
Peak:m/z	Relative Intensity
101.1659698	0.45
102.9508820	4.26
103.8599091	0.70
104.8133621	4.43
108.8186111	0.26
109.8720856	0.09
110.9752197	5.58
112.0107651	1.16
112.9825287	14.37
114.9334412	1.96
116.9261932	0.29
118.9565659	2.37
119.9848557	0.26
123.0075607	0.29
124.7874756	1.39
126.9410400	1.53
128.0087280	0.68
129.0166626	58.73
130.0182953	0.36
131.0522919	3.51
132.9067078	0.70
135.1626587	0.75
136.9065552	100.00
137.8137665	0.87
139.0165558	0.79
141.0816956	0.51
142.9665222	0.83
144.8843994	12.31
146.9852905	4.54
148.0582275	0.48
149.0217590	0.36
150.9903564	2.28
152.0593567	1.02
152.9644165	1.45
154.8997803	0.53
158.7005310	3.84
159.4721375	0.29
160.9633484	6.41
162.9504089	2.38
164.9570007	1.51
167.8092346	0.26
168.9333496	12.34
170.9818420	9.15
172.9864807	0.14
174.9160156	8.93
176.9529419	0.71
179.0159912	1.06
181.1076202	0.06
182.9686890	0.60
184.9303589	2.72
186.1509705	0.50
187.1117554	0.29
189.3459930	0.54
190.6266785	0.44
192.7313843	7.66
193.3685303	0.19
194.9619751	3.70
196.7104797	0.25
198.1085815	0.27
199.1425781	0.25
200.8548584	4.67
202.9348145	7.52
203.6061096	1.38
207.2362823	0.55
209.0514221	1.57
210.7489166	1.58
215.2431946	0.11
216.2812805	0.39
217.0020447	0.76
219.0195312	4.57
221.0018616	0.14
223.9999390	0.24
224.9561768	1.10
226.8771667	1.01
232.4106140	0.22
233.1538086	0.76
234.8591614	2.99
235.6052246	0.08
239.1059265	0.89
241.2073364	0.56
242.7614136	0.26
245.0749817	0.65
248.9783325	8.78
250.1359558	4.47
251.0167236	7.79
251.9649963	0.19
257.1064758	1.60
261.2897949	0.53
262.7739868	0.13
263.3920288	0.47
264.0264282	0.66
265.0859985	0.07
266.9378967	32.99
268.8163452	0.50
272.2818298	0.18
274.5677490	0.11
276.8293152	0.29
280.6744995	0.61
282.2436523	0.57
283.1659851	0.90
285.2414246	0.18
289.3108826	0.20
292.3114014	3.40
293.2254028	1.21
297.3634644	0.44
298.9221191	2.82
301.5758362	0.29
307.2132568	0.88
310.4002380	0.78
312.0760803	16.11
313.0697632	7.72
315.0137634	0.59
316.1362915	0.19
320.1278076	3.55
321.3082581	3.89
323.3176880	0.09
324.0740356	0.40
324.9008179	1.21
325.9622192	2.92
329.2716675	0.08
333.2553711	0.09
338.1861572	20.74
339.3070984	18.46
340.2046509	0.44
348.2408142	0.81
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	441.1978
Annotation	Unknow
Peak:m/z	Relative Intensity
158.9511719	0.03
210.0929565	0.06
246.1747742	0.03
249.3160400	0.09
291.0625000	0.10
293.3653564	0.05
294.1194458	0.26
311.2077637	0.04
322.2667847	0.03
323.0640869	0.03
326.4294434	0.06
345.0743103	0.06
362.5810242	0.28
363.2334595	0.14
378.1119080	0.05
379.2302551	0.07
395.1922913	100.00
396.8634338	0.10
400.2911682	0.04
406.5177307	0.10
422.1197815	0.05
423.2324524	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	827.268
Annotation	Lantanose A
Peak:m/z	Relative Intensity
263.0800476	0.13
305.4242249	0.09
323.1208191	3.27
341.0649414	5.39
347.0425415	0.15
358.8312988	0.15
371.0211792	0.33
383.2632751	7.60
388.9914551	0.42
395.3330688	0.47
397.3150024	0.20
442.1129150	0.17
443.5802612	0.05
449.1795044	0.08
467.4566650	0.25
479.4398193	0.33
485.3833618	2.72
503.2472534	7.68
504.6295166	0.09
509.4501343	0.41
545.3204956	100.00
557.1118774	0.45
569.3678589	0.79
577.4430542	0.19
601.4013062	0.42
608.5307007	0.76
635.4199219	0.13
647.2710571	8.88
650.1992798	0.32
665.4362793	10.33
707.3350830	0.86
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	551.1771
Annotation	Lactucaside
Peak:m/z	Relative Intensity
164.9884949	1.68
177.9437866	1.74
181.0570679	0.12
191.0858459	0.10
193.0433807	34.83
195.1442871	4.69
203.6013489	0.29
217.1750183	0.67
219.2083588	0.11
227.2501068	0.05
229.2002563	0.08
235.1190186	0.52
240.9022827	0.24
247.2061310	0.28
270.3455811	0.12
285.1211243	0.14
286.0479736	0.12
289.1752930	0.18
296.8563232	0.26
301.0182495	0.13
314.2208252	0.14
321.1821899	0.11
325.2329712	0.30
329.2885132	0.10
341.2035522	19.40
345.4310913	0.08
353.2889404	0.12
355.2871704	0.13
358.1635742	0.39
359.3316650	0.13
363.3303223	0.12
364.8483887	0.11
370.5303345	0.79
371.3060303	0.06
372.1976318	0.34
376.9494019	0.52
384.0691528	0.13
386.3018188	0.11
389.1080322	100.00
398.0185547	0.15
405.2277832	0.05
413.2538452	0.25
422.5286255	0.16
429.3778687	0.13
431.2386475	1.39
433.1352539	0.25
434.9114990	0.17
435.7099609	0.36
443.2542114	0.18
445.4288940	0.11
446.9360962	0.07
448.2274780	0.07
449.1723022	0.04
452.8578491	0.37
458.0549316	0.19
459.2949219	0.26
463.4484253	0.11
473.2960815	0.15
477.1290283	0.06
489.7849121	0.20
491.0857544	0.65
493.3876953	0.46
502.2120972	0.35
504.1007690	1.45
505.3124390	2.11
506.4069214	0.51
507.5501099	0.64
509.2980347	0.47
510.2936401	0.49
515.6563110	0.15
520.1860962	0.36
532.1284180	0.64
533.1967773	0.93
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.02
Annotation	Unknow
Peak:m/z	Relative Intensity
96.7840881	0.08
102.8200912	0.41
104.2537766	0.29
104.8901978	0.29
105.8655396	0.13
106.8952332	1.38
109.0488129	1.32
110.9491577	1.45
112.9196320	2.31
117.0232086	0.79
120.9573441	3.38
122.9257202	0.92
125.0956955	1.05
127.0630493	0.25
128.9418335	0.74
130.9330139	1.83
132.9951324	1.11
135.0841370	4.29
136.8539429	1.44
138.0456238	0.33
139.0156555	1.18
140.5344696	0.10
141.1686096	0.28
142.9059753	4.53
144.0329590	0.93
144.9357605	2.50
145.9998474	0.58
146.6990051	0.30
149.1507874	1.56
151.0964813	5.40
152.0859070	5.00
153.2097626	1.14
154.1259003	0.24
155.1532135	0.25
157.0846710	2.33
158.9924316	3.73
160.0015869	0.32
160.9197693	3.66
161.9820251	1.24
163.0452881	2.38
165.0206299	0.76
167.0044708	0.82
169.0246277	2.15
171.1091766	0.30
173.0673981	1.82
175.0021362	1.56
176.0552521	0.09
176.9749298	1.23
178.2408447	0.24
179.0603638	0.36
183.0141907	1.27
185.1674957	1.51
187.0727539	4.37
189.1128540	0.50
190.2794800	0.38
190.9444885	1.16
192.3017578	0.31
192.9576416	1.43
194.9912109	0.38
196.9473877	0.11
199.0870667	0.23
199.9930573	0.12
201.0649872	1.51
202.1197205	0.27
203.0337677	0.87
205.1623077	0.26
208.5477600	0.09
209.1843262	0.14
210.3303833	0.28
211.1084900	1.54
214.1408081	0.08
215.1291504	0.67
215.9523926	0.72
216.9980164	2.96
217.8751221	0.76
218.9815063	4.35
219.5947571	0.04
221.1015015	0.13
223.1477661	0.49
224.5065918	0.79
225.4055481	0.17
227.0407715	0.36
228.9818115	0.14
231.2527466	0.98
233.0185852	1.27
234.1396484	1.39
235.0025330	2.17
235.9075012	1.43
237.0878906	0.10
239.4050598	0.75
241.2784424	0.08
242.0820312	0.12
243.2466125	0.06
243.9913330	0.20
245.1895142	2.72
247.2914124	7.85
251.2608032	0.08
255.3116455	0.59
257.3733521	0.26
259.3636169	1.11
264.5137329	0.57
265.5730286	0.35
267.0003052	3.34
268.0993042	0.30
268.8876953	0.10
271.2724915	0.33
273.2504578	0.29
277.1948242	0.18
278.9584656	0.16
282.9518433	0.40
284.9870300	0.25
287.4143372	0.66
289.0993652	0.69
294.3210449	0.42
295.1676636	1.51
296.0975647	0.36
297.4891968	0.18
299.0590515	0.59
300.1186523	0.37
303.0630493	0.25
305.3361816	3.11
307.3633728	0.33
309.2872314	0.70
310.3620300	0.38
312.2797241	0.23
323.2260437	100.00
324.0130615	0.18
338.3036194	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	379.08
Annotation	Didymocalyxin C
Peak:m/z	Relative Intensity
112.9979324	0.13
119.0561981	0.04
142.9838867	0.07
161.0170288	0.09
179.0009918	0.95
179.8905640	0.04
197.1636047	0.09
198.9128418	0.57
215.1116943	1.44
216.0598297	1.50
217.0781555	8.14
341.2312622	100.00
342.1325684	30.83
343.2286987	9.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	356.102
Annotation	Deoxyviolaceinic acid
Peak:m/z	Relative Intensity
113.2737350	0.16
114.0016708	0.62
118.9260864	1.55
130.8718872	1.49
132.1621704	0.14
135.1107941	0.42
142.9936371	0.17
149.0425720	1.21
160.9664917	1.28
175.9907837	100.00
176.9791107	0.34
179.0117340	15.86
265.2114258	0.09
337.3235474	0.57
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	312.1257
Annotation	Unknow
Peak:m/z	Relative Intensity
104.9211426	0.05
110.9940491	0.03
112.0976715	0.03
113.0355682	0.06
125.0695648	0.04
134.0690613	0.01
137.0044403	0.03
146.9717102	0.08
153.1254578	0.02
165.1337738	0.02
166.0680237	0.02
175.2627563	0.03
178.0640869	0.25
179.1134644	0.04
181.1436157	0.02
181.8922882	0.04
185.1523285	0.06
187.7515564	0.01
188.3878784	0.02
194.1482849	0.03
204.0340271	0.48
204.9967041	0.09
206.0248108	0.13
209.2367249	0.05
210.7492981	0.02
214.6477051	0.08
218.1365356	0.06
222.0627441	100.00
223.0391541	0.04
234.2221375	0.04
235.4867859	0.03
237.9768372	0.05
239.0541382	0.03
239.9565125	0.11
258.3030090	0.06
266.1663513	0.07
267.0063477	0.20
268.0192261	0.21
269.1680908	0.22
271.1417847	0.05
275.4506226	0.11
277.2474365	0.06
293.2999878	0.33
294.1832886	0.31
295.2324829	0.98
303.3053589	0.11
311.4548035	0.03
312.6745605	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	191.0196
Annotation	Diketogulonic acid
Peak:m/z	Relative Intensity
85.0135956	0.35
86.9922180	0.61
100.9802246	0.09
110.9223328	100.00
129.0035400	2.28
130.8449860	0.73
146.9479828	0.06
154.9438324	0.24
172.9696960	23.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	395.1922
Annotation	Creoside IV
Peak:m/z	Relative Intensity
112.9514008	0.55
114.9914246	0.18
123.9960327	0.03
125.0695038	0.23
126.8452682	0.06
128.9805298	0.21
142.9485474	0.71
145.0812988	0.24
159.0715637	0.36
161.0243530	8.63
163.1123505	0.33
188.9713745	0.11
196.2999115	0.02
200.1313171	0.06
205.1171875	0.08
228.9702759	0.88
231.0760498	0.11
233.3178711	0.08
247.1562195	0.18
249.1354065	100.00
249.7615967	0.17
254.0348816	0.08
264.8332214	0.06
271.0217285	0.12
289.3405762	0.05
291.2878418	0.14
292.2284546	0.03
295.3342590	0.08
305.1972046	0.08
307.2264404	0.09
316.1661987	0.13
348.0877686	0.09
348.9713135	0.16
351.1078186	0.15
357.4365845	0.08
358.3489685	0.10
361.9591370	0.06
377.3460999	0.50
378.1624451	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	226.1181
Annotation	alpha-[3-[(Hydroxymethyl)nitrosoamino]propyl]-3-pyridinemethanol
Peak:m/z	Relative Intensity
83.8958435	2.32
101.8562012	0.26
107.1994781	0.08
119.9635925	1.70
121.0183716	0.13
130.0169525	37.95
130.9171600	2.73
132.4663239	0.22
136.8783264	0.07
139.8764648	0.04
148.2148895	0.02
151.8548431	0.87
152.8421478	0.21
153.5580750	0.13
157.2072296	0.04
160.2465668	0.12
161.6347656	52.23
162.6145172	0.40
164.3477020	0.24
165.1913605	0.06
166.3708344	0.61
168.1014099	0.03
171.8355560	0.24
175.0876770	5.72
176.1826324	0.30
176.8969879	0.08
180.5202789	0.12
181.3505402	0.18
184.4145050	0.12
185.9898682	1.64
187.0117493	0.12
188.0551910	0.04
194.6629944	21.68
195.6747284	0.04
198.5238800	0.34
202.1813507	0.11
205.5242310	0.07
208.7946167	0.96
209.5354767	0.07
213.9585419	1.35
215.1284332	0.15
217.7070923	100.00
218.7201233	0.88
221.5441895	0.02
232.5668793	0.04
241.7535248	0.11
259.4046326	0.14
277.2911987	1.37
278.2165527	0.20
286.3705444	0.23
295.5388489	0.08
304.1784668	0.02
306.1527405	0.05
322.2647400	63.80
323.2641907	9.73
324.1796265	0.29
350.2820129	0.07
435.5261841	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	463.0881
Annotation	6-Hydroxytricetin 5-rhamnoside
Peak:m/z	Relative Intensity
138.1464539	0.07
150.9687195	0.35
163.0501404	0.20
168.9709473	0.02
179.0139465	0.49
185.2038574	0.09
186.8982239	0.07
189.0276794	0.07
190.0913544	0.03
191.2810669	0.02
192.9637756	0.10
204.9422913	0.06
220.5892029	0.05
229.0846252	0.27
240.8971863	0.07
247.1345520	0.06
253.0860291	0.06
255.2805786	0.16
257.2158508	0.10
263.1631775	0.09
269.1801758	0.08
271.1183167	0.51
273.2040405	0.46
282.4401855	0.06
284.8796692	0.16
287.5240784	0.04
294.8571777	0.03
297.0182800	0.18
299.1795959	0.46
300.1054382	21.69
301.0526123	100.00
302.2552795	0.16
305.2050476	0.09
313.0284119	0.73
314.9742737	0.22
319.2620239	0.29
324.2586365	0.12
325.0578613	0.08
327.2289124	0.14
335.3986816	0.17
337.1753540	0.15
343.1369629	1.77
353.5883484	0.19
355.9759521	0.18
357.2623901	0.08
363.3354797	0.16
367.1717529	0.08
373.0945740	0.09
374.2463684	0.09
375.2104797	0.25
376.3315125	0.07
377.3011475	0.22
382.5686951	0.03
391.1976013	0.13
395.3800964	0.06
399.3258972	0.18
403.2288208	0.21
405.9792786	0.06
409.0365295	0.07
416.8294983	0.18
419.1748962	0.18
421.0689697	0.26
421.8822021	0.16
426.9532166	0.48
432.3599548	0.22
433.3104553	0.17
443.0701599	0.17
444.2089539	0.14
445.2767029	1.03
446.2106323	0.06
447.6954041	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	354.07
Annotation	Unknow
Peak:m/z	Relative Intensity
118.9687729	0.08
121.7693787	0.21
124.1452789	0.09
130.1120911	0.07
143.8792725	0.17
145.8786011	0.08
150.0231323	16.80
150.9745789	0.13
152.0678711	0.37
153.9851990	0.44
156.9868927	0.13
158.9460754	0.43
159.5764160	0.09
161.1764221	0.02
163.0750427	0.91
167.1364288	0.77
168.8472900	0.04
171.1881409	0.02
174.2946472	0.02
174.9578247	0.02
176.9661255	0.17
180.8416748	0.08
181.4605560	0.08
188.0836334	2.94
199.0619659	0.06
203.1832581	0.33
205.0115662	8.78
207.1161804	0.17
215.1045227	0.49
219.1423035	0.13
224.0575256	0.04
225.1083374	3.63
232.6687012	0.04
237.1617126	1.23
240.1899719	0.16
245.8099060	0.09
249.1469727	3.09
263.2271729	0.58
265.4587708	0.10
267.1343079	2.67
269.3895264	0.07
273.0455017	0.23
274.0274048	0.04
275.1380005	9.73
281.2070923	52.92
282.1747437	0.06
292.1685791	24.88
293.2046204	16.48
294.5661926	0.10
299.5571899	0.24
304.0938416	0.17
307.4255371	0.26
308.3690491	0.10
310.1784058	100.00
318.2023926	0.08
319.1446533	0.38
326.3266907	0.23
333.1583862	0.07
335.5740662	0.45
336.3049316	2.28
337.0177307	3.44
339.3608704	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	165.04
Annotation	2-Dehydro-D-xylonate
Peak:m/z	Relative Intensity
57.0197258	0.04
58.8020668	0.03
68.8786774	0.04
72.8397980	100.00
73.9704590	0.27
74.9007797	1.27
78.9104919	0.17
82.8698425	0.07
86.8699417	0.28
88.8988190	0.61
89.9088593	0.11
90.8351517	1.52
92.9243927	1.59
94.7693176	0.38
100.7294769	0.05
103.0146484	0.11
104.8975830	2.93
106.8242798	0.17
108.9927826	0.40
112.2103119	0.13
112.9901581	0.09
118.6601715	0.02
120.9552612	0.20
122.7574768	14.00
147.0375214	0.32
152.9755859	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	342.3
Annotation	C-2 Ceramide
Peak:m/z	Relative Intensity
107.9748077	2.39
117.0785828	0.49
119.074852	1.62
123.0668488	0.91
131.1159821	2.40
135.3070984	2.29
136.031189	0.74
149.9885254	0.36
156.1420593	1.45
158.9101562	0.32
161.9602051	5.90
167.9143829	2.21
170.3118896	1.87
176.1383667	1.30
188.2599487	0.32
189.3661957	0.32
190.2258606	2.71
198.2009277	1.76
201.2731323	1.26
204.1480408	2.65
205.2806396	1.83
207.5489807	0.39
208.2822876	0.28
210.0759888	0.90
215.1022339	0.55
218.0165405	0.28
220.3621216	2.47
222.1922302	1.41
224.2513123	1.94
229.1173401	0.78
231.96875	1.48
234.0812073	1.57
239.8666687	1.22
241.1773071	0.85
248.4967346	3.27
250.0792847	0.74
251.6604309	2.27
252.2750854	1.72
254.3135376	1.24
255.149353	1.67
263.2993774	2.93
268.0578918	1.78
271.7322083	1.45
276.5408936	1.12
280.3718262	13.73
282.0012817	0.71
283.5003052	2.70
289.1890869	1.55
293.2383423	25.07
296.3011475	2.23
297.0239258	1.50
298.359436	30.74
300.1882324	7.14
301.1754456	0.82
303.0688477	1.00
304.2182007	0.78
305.0020752	1.74
306.6196899	13.89
307.3540955	6.04
311.3392334	6.18
314.1523743	3.93
319.7162476	4.97
324.2901306	100.00
325.1498413	24.25
326.4501038	2.78
328.2163696	6.51
342.3377991	1.42
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.1514
Annotation	Hexazinone
Peak:m/z	Relative Intensity
91.9836731	0.03
93.9594421	18.53
96.9666138	0.03
112.0403137	0.02
121.8389282	0.04
128.2793579	0.04
163.0389709	0.06
190.1272430	2.52
191.1822968	0.03
207.1453400	4.06
209.1896515	100.00
216.0682526	0.06
216.9185791	0.12
221.1121368	0.02
234.0758209	22.77
234.7165680	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	386.9385
Annotation	Unknow
Peak:m/z	Relative Intensity
158.9949341	0.39
160.0476074	0.18
229.7284851	0.05
271.1951599	0.17
272.9768066	100.00
273.9654236	70.55
274.9683838	0.23
299.6621704	0.10
313.1653748	0.05
315.9406128	0.08
341.1710205	1.37
342.2346802	0.13
343.8628845	0.07
356.7670898	0.05
369.9773560	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2419
Annotation	18-Hydroxyoctadeca-9Z,12Z-dienoic acid
Peak:m/z	Relative Intensity
95.21746063	0.18
97.1011734	0.68
99.01570129	0.57
101.1815109	0.42
103.0562134	0.12
107.3296738	0.15
108.9769897	0.51
110.9748383	0.49
111.9696198	0.21
117.1165771	0.15
119.0710373	0.54
122.9852142	0.70
125.0071487	1.07
127.0147247	0.41
134.6741638	0.67
137.1444702	1.02
139.0092773	8.76
149.059906	0.52
153.1069946	1.73
155.2444916	0.13
157.0754852	0.12
160.8998566	1.41
164.8530579	0.65
166.0633545	0.55
167.0419006	0.98
168.777298	0.11
173.1934204	0.50
179.3312683	0.55
181.1387939	0.21
183.071228	0.19
185.1469116	0.32
189.3398132	0.11
193.1424255	0.89
195.1609344	0.18
196.9590302	6.48
203.1055298	0.23
206.9472046	0.32
209.120636	0.18
210.8477173	0.32
215.0019226	1.14
219.2609863	2.02
221.2211914	5.42
222.0370789	0.65
223.3193054	0.63
225.0704651	0.47
227.3966064	0.21
233.4575195	0.87
235.2289734	0.69
237.2698364	3.48
239.0812683	15.04
239.7445068	0.42
243.1751709	0.38
251.4234619	0.60
253.1397095	2.52
255.146637	1.95
257.166748	0.46
261.2866211	1.43
266.0669556	0.29
268.8346863	0.27
279.2357788	100.00
280.3127136	0.29
281.1922607	1.13
297.0880432	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	611.1849
Annotation	Unknow
Peak:m/z	Relative Intensity
179.2126923	0.29
202.2097168	0.08
207.9785156	0.12
214.9696198	1.22
216.0304260	0.31
225.0105896	0.11
231.2412262	0.28
233.0500031	0.12
249.1104736	1.82
250.1601410	1.24
251.1201782	0.96
257.3048401	0.32
266.9763794	0.10
270.1315918	0.22
275.3272705	0.05
277.4355469	0.19
279.2187195	0.12
282.1794434	0.04
289.3753662	0.06
299.9598083	0.46
306.4501953	0.18
307.1193237	0.08
309.1651917	0.07
310.4147949	0.10
311.1300049	0.08
315.1956177	0.24
316.2152710	0.71
320.9874878	0.16
326.0125122	0.07
328.1163940	0.16
341.0030518	0.24
344.2308350	1.53
345.9722900	0.31
359.2495117	0.17
360.9923706	0.12
371.5062866	0.07
373.2000732	1.08
377.2621460	0.14
377.9705811	0.22
385.2962646	0.08
387.2025146	0.22
393.4893188	0.24
395.9038086	0.13
403.1892700	0.37
406.2142334	0.22
407.3107300	0.15
417.2301636	0.79
418.3613281	0.09
419.3338623	1.55
420.7536011	0.07
431.2511597	1.31
435.3040161	0.21
439.4666748	0.09
440.3889771	0.26
443.4304810	0.94
444.3930664	0.06
447.3060303	0.30
448.3016357	1.20
449.5061646	2.02
451.1929321	1.42
455.0064697	0.10
457.2611694	0.10
463.2464600	3.79
464.5966797	0.18
468.2844238	0.78
471.5737915	0.17
475.4376831	0.20
477.3335571	0.69
478.6297607	0.27
479.9758301	1.04
481.1181030	1.53
482.3490601	0.48
487.6066284	0.61
488.5863647	0.13
490.1718750	0.08
491.3407593	0.94
493.8196411	0.14
495.1179199	34.07
496.2261963	0.05
502.9017944	0.11
505.4154053	0.44
506.6522827	0.26
509.0873413	0.21
512.1976929	22.50
513.9277954	0.12
515.4325562	0.48
521.1759033	12.13
522.4439697	0.17
523.5209351	0.70
524.3290405	0.73
542.3801880	0.33
548.3869019	0.04
553.1776733	100.00
565.3919067	0.45
566.2977905	0.21
567.3220215	4.75
570.1502075	48.06
573.2709351	0.44
581.5199585	0.07
587.6647339	0.06
591.3189087	0.10
592.3489380	1.02
593.2243042	1.69
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	445.1873
Annotation	Cornutin F
Peak:m/z	Relative Intensity
127.3391953	0.23
128.1153564	0.25
131.0793152	0.31
135.9525299	0.11
145.0282288	1.15
146.1902771	0.16
152.8900146	0.44
155.9622650	0.39
167.2183838	0.04
171.1713562	0.11
173.1693115	1.84
179.0343018	3.18
180.2351685	0.20
181.2144012	0.13
182.1681824	0.15
183.2739258	0.06
197.1475525	1.59
198.2295990	1.53
200.2137604	0.85
208.0106812	0.56
215.0687561	0.26
216.1577606	0.25
219.2721405	0.04
225.1141357	3.00
226.1442871	0.48
227.2803040	0.04
239.0542297	0.20
242.1995544	21.56
243.0083313	0.18
244.0993652	0.77
253.0102234	0.16
266.1302795	0.48
267.2281799	1.18
270.2693481	0.34
271.1058655	0.18
282.2792664	0.04
284.2028198	0.87
284.9958496	0.34
289.1815796	1.15
291.1137390	0.11
291.7299500	0.08
293.3001099	0.54
299.2318726	0.04
309.2962341	4.52
310.0720215	0.25
311.3433228	0.52
316.2096558	6.50
317.3171997	0.14
327.3429260	6.15
329.2793274	0.87
335.2225647	0.25
336.2001953	0.14
339.5648193	0.07
341.5197754	0.12
348.9533691	0.19
350.8182983	0.05
353.1992493	46.61
354.1806030	1.21
367.1342773	0.12
371.2335815	100.00
371.8446960	0.22
373.3029480	0.17
376.1889343	0.11
377.3438721	0.14
385.2863464	1.06
399.2626648	0.52
401.1049805	0.53
401.7893066	0.03
403.1953430	3.19
410.2691956	0.31
427.2628174	43.38
428.1976624	1.37
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	323.03
Annotation	Unknow
Peak:m/z	Relative Intensity
94.9497757	0.17
106.9710236	0.32
111.1345215	0.18
115.0042725	0.16
117.0165710	0.22
119.0853500	0.45
120.0050583	0.09
120.9904480	0.12
123.2317963	0.25
126.0389099	0.13
126.9718475	1.93
129.0491028	0.47
130.8810577	0.16
135.0505676	0.11
137.0390320	0.26
138.9137573	0.28
140.9992065	0.34
142.9819336	0.86
143.9803162	0.13
145.1067200	0.32
149.0255737	0.18
151.1270142	0.17
152.1659241	0.08
152.9546509	0.48
154.9564514	0.19
156.9674377	0.25
158.9658203	4.02
160.2135925	0.18
160.9996948	0.06
163.0697021	0.22
167.2850800	0.23
169.0165863	0.25
170.1571045	0.33
172.0429230	0.06
174.9305725	0.91
181.1638184	0.08
183.9879913	5.53
184.9450226	0.41
191.0030518	0.13
191.9238281	0.08
193.0355988	0.11
193.8692627	0.21
195.0349731	0.22
198.2054443	0.21
200.1328583	0.12
201.1149902	0.42
205.1163635	0.15
207.0914001	0.06
211.2717896	0.04
216.2203064	0.42
217.1320496	0.25
218.3149719	0.41
223.2331543	0.09
224.4302063	0.06
225.1288452	0.14
231.1536560	0.22
232.9811707	100.00
234.0685730	1.12
235.4947205	0.48
237.1023560	0.14
238.1126404	0.03
247.3146362	0.24
248.0735474	0.23
249.0270386	1.60
250.2579956	0.17
251.0865479	0.09
262.9677429	0.18
263.7637329	0.20
266.2664795	0.09
269.4536743	0.33
277.1586914	0.20
278.2914429	0.51
280.1639404	0.08
281.2752686	0.11
282.1541138	0.41
287.0351562	0.61
287.7002563	0.03
290.1642151	0.10
291.2850952	0.37
294.2177124	0.06
295.3478394	0.11
299.3505554	0.09
304.2928162	0.59
305.2521057	3.48
306.2829590	0.05
308.2100220	0.26
313.9572754	0.43
322.6319275	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1313.4261
Annotation	Unknow
Peak:m/z	Relative Intensity
380.8020325	0.48
383.2205811	3.74
396.9725037	0.06
413.1464844	0.05
421.2396240	0.34
453.3154907	0.08
467.2332764	0.18
473.0366211	0.25
485.1700439	5.34
485.7807007	0.13
503.3328247	5.30
527.4509277	0.52
543.3721924	0.46
545.2722778	9.61
551.1620483	0.24
557.3981323	0.73
561.3107300	0.33
581.5853882	0.29
604.5532837	0.18
611.3126221	0.55
625.3923950	0.48
629.0545654	0.08
647.2764893	8.00
665.3546143	7.77
689.6025391	0.55
701.2413330	0.17
707.3494263	26.76
719.2977295	2.62
721.2768555	0.43
731.4075317	0.57
735.4216919	0.22
771.2385864	0.11
791.2078247	0.12
809.3771362	25.27
827.3262939	31.55
851.4215088	0.16
867.5208740	0.51
869.2668457	17.47
881.2083740	0.27
883.4011230	0.09
893.2526855	0.31
897.5103760	0.33
899.4346924	0.94
901.5806885	0.22
911.2988281	0.11
935.7570801	0.44
971.3880615	32.43
988.7690430	0.71
989.4085693	35.05
1029.2696530	0.30
1031.4226070	49.37
1043.2302250	1.63
1045.3413090	0.19
1055.3056640	0.17
1063.5781250	0.90
1073.3659670	0.12
1115.3399660	0.49
1133.4593510	28.59
1151.4113770	100.00
1193.3627930	1.10
1223.5700680	0.32
1293.9316410	0.37
1295.4648440	1.58
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	563.2
Annotation	Unknow
Peak:m/z	Relative Intensity
161.0288391	0.39
163.2452087	0.11
167.0169373	0.28
179.0207672	1.74
183.1433258	0.04
197.1971893	0.14
202.8102722	0.15
209.1447906	0.09
221.0712128	3.29
226.8708191	0.17
234.3791199	0.18
239.0896759	0.34
241.1416931	0.17
245.1228333	0.13
262.9963379	0.91
269.1304626	0.11
271.1836853	0.13
273.4078979	0.05
279.0578613	0.14
282.2796936	0.20
283.4070435	0.19
285.0665283	0.17
301.0154419	0.12
304.6610718	0.06
316.3799438	0.10
323.0740356	100.00
323.6929321	0.42
325.0997925	0.18
326.0939941	0.73
337.0425415	0.10
338.1998901	0.04
339.0905151	0.13
345.2164307	0.20
353.4313965	0.32
357.4487305	0.22
369.6833496	0.26
371.2346802	0.17
374.0666504	0.14
382.4037476	0.14
383.1855469	0.38
383.9433594	0.04
384.5601807	0.08
385.5231934	0.14
398.1582031	0.08
400.2132568	0.94
401.2872314	1.09
402.0708618	0.94
403.6334229	0.16
409.3355713	0.15
426.1146851	0.12
429.9398804	0.04
432.5148315	0.08
440.6519775	0.08
443.5256348	0.44
444.2819824	0.35
445.1646118	0.38
453.1883545	0.33
457.2282715	0.50
461.1276855	0.35
469.0498657	0.21
470.2365723	0.09
472.7277832	0.04
474.5786743	0.19
475.3212891	0.68
484.4703979	0.06
487.2274780	0.44
488.2892456	1.40
489.2847290	0.89
493.2736206	0.07
503.2794800	1.33
504.1703491	0.06
505.2012329	0.35
506.3985596	0.07
516.1702271	4.91
516.8362427	22.11
517.5969849	1.03
518.4167480	0.25
519.2587280	1.41
521.3856201	0.75
522.1688843	0.07
524.4210205	0.04
539.4008179	0.23
544.1567993	3.59
545.3928223	1.83
549.4475708	0.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	307.1
Annotation	gamma-Glutamyl-S-(1-propenyl)cysteine sulfoxide
Peak:m/z	Relative Intensity
87.8780823	0.10
107.9417572	0.08
114.0086899	0.04
114.9259033	0.08
118.1196747	0.02
120.8786087	0.05
127.0116348	0.11
130.0290222	0.46
131.9392395	1.09
142.6312256	0.06
160.0381470	3.20
160.9603882	0.05
162.9629211	0.05
173.1316223	0.03
176.1608887	0.09
178.0221100	11.22
186.0196838	0.10
199.1245117	0.19
202.0201111	0.04
204.9163513	0.03
208.0493164	0.04
217.0350342	100.00
229.0992737	0.05
241.1135254	0.10
242.8942871	0.02
244.0292053	0.05
249.0979614	0.04
250.2484436	0.02
261.1487427	0.05
266.1617432	0.14
271.1883850	0.07
278.6983643	0.01
288.4972229	0.38
289.1176147	0.46
290.1391602	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	410.33
Annotation	Unknow
Peak:m/z	Relative Intensity
122.9140091	0.09
123.9586029	0.04
126.2021790	0.60
131.1239319	0.04
132.9945374	0.22
134.8830872	0.15
137.1806946	0.17
138.0074921	0.90
139.0251617	0.06
143.2678528	0.26
147.1481171	0.10
148.0029602	0.15
150.1121826	0.22
151.1519012	0.14
154.0015259	2.82
154.9984589	0.26
161.2576752	0.39
162.6765137	0.07
165.2709961	0.04
166.0292358	0.28
171.1434937	1.54
175.0604858	0.06
180.0215607	0.08
182.0672150	0.19
184.0972290	0.08
184.7623444	0.19
186.3648987	0.08
194.9475708	0.40
196.0003357	0.10
199.3970947	0.10
200.1146088	0.13
201.0078278	0.03
209.0708618	0.35
209.7110901	0.07
223.2295532	0.36
227.0979919	0.14
238.1915588	0.04
239.3119202	0.06
242.1940918	0.36
245.0952759	0.64
263.3143616	1.78
270.4297485	0.17
271.2334595	0.10
279.2257385	0.14
281.3111267	0.24
296.7213135	0.16
311.3492126	0.14
317.2891846	0.21
321.0676270	0.09
322.9662476	0.45
324.2676697	0.24
329.1239014	0.40
333.2038269	0.18
334.3704224	0.06
337.1226196	0.31
344.4259033	1.38
346.8336792	0.14
350.2691040	0.07
351.4585266	0.20
353.9184875	0.56
354.6812744	0.10
356.4793701	3.01
362.3530884	0.90
364.0165100	0.12
367.9949341	0.26
369.4241943	0.38
373.2483215	0.34
374.3762512	14.52
375.2301331	0.32
378.3923035	0.24
379.0415955	0.23
382.4135742	0.42
392.4027100	100.00
393.4584045	1.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	469.96
Annotation	Unknow
Peak:m/z	Relative Intensity
145.0297546	0.30
146.0575256	0.05
151.8831329	0.05
161.4218445	0.52
162.1201324	0.40
163.9032593	0.34
175.9990387	0.32
188.3208618	0.11
189.0867310	0.05
189.9020996	0.81
198.0984192	0.09
206.0201416	0.08
209.2971497	0.14
212.7259674	0.16
215.8860626	0.39
217.1179810	0.42
218.9299011	2.05
220.8371124	0.12
221.7857971	0.06
231.0990906	0.04
232.9810791	0.12
234.7051392	0.12
235.8272400	0.87
237.9432678	0.40
242.2509613	0.25
244.6983948	0.25
246.3971558	0.15
250.5534363	0.31
259.9580994	0.28
262.0670471	2.13
262.9114685	0.46
263.8339539	0.32
276.2366028	0.26
278.9697876	0.12
279.7400818	0.23
282.4195557	0.08
283.2840576	0.22
288.9513855	0.25
291.0563049	0.04
292.1052246	0.27
297.3092041	0.17
298.0738525	0.15
298.8237305	0.18
300.2510681	0.36
302.5836792	0.09
305.9573975	0.62
307.8540649	100.00
308.4549255	0.58
319.0986938	0.26
322.9743958	0.09
329.8053589	0.03
330.9848633	0.42
332.3524780	0.23
334.9778137	0.17
348.9755249	0.46
356.1263428	0.08
357.2525635	0.05
362.3051147	0.06
362.9353638	0.07
364.1364441	0.10
365.8890686	0.14
376.4185486	0.65
377.4617004	0.90
378.4877625	0.10
380.9508972	0.93
382.2008972	0.29
385.8792419	0.06
388.1228943	0.20
389.1054688	0.56
390.0193176	0.52
391.1318359	0.09
395.0356140	0.32
399.8896179	0.25
400.5163879	0.07
407.2159119	0.18
413.5841980	0.11
415.5786133	0.07
423.1349182	0.23
425.1215515	0.33
427.7761841	0.11
428.4730530	0.15
438.1756287	0.05
441.3814697	0.15
447.4521484	0.14
450.9428101	0.46
452.0830688	0.17
452.8840027	0.13
456.2651978	0.31
460.7979126	0.13
469.8531189	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	455.1768
Annotation	Unknow
Peak:m/z	Relative Intensity
136.7022705	0.14
143.0702972	0.12
145.0415039	0.09
157.0504150	0.10
161.1268768	0.12
162.9964905	5.40
166.8006897	0.02
204.9471436	0.09
207.3495789	0.04
233.3665466	0.27
234.8331299	2.70
240.4649963	0.07
245.1892090	0.10
249.3002319	0.17
252.9277649	0.18
254.4886475	0.18
263.3883972	0.05
264.8327637	4.47
266.0483093	0.12
275.2882690	0.10
276.7366943	0.05
283.5484314	0.12
288.9735718	0.06
290.3645630	0.23
292.6283264	0.11
295.1076355	0.26
307.1354370	1.53
307.9749146	0.16
317.0173340	0.05
325.0975647	4.12
335.3527222	0.03
341.1151733	0.41
350.2453308	0.05
353.0259705	0.02
365.2299805	0.04
367.2951660	0.15
397.5274353	0.08
409.1746826	100.00
410.1646118	0.08
411.5361328	0.18
413.1294861	0.04
414.3184814	0.08
419.4535217	0.07
423.0562744	0.05
437.1487427	0.33
445.6631165	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	245.1143
Annotation	Leucyl-Aspartate
Peak:m/z	Relative Intensity
116.0843811	2.35
128.0210724	100.00
153.0408783	0.32
156.9294586	0.05
170.9975433	0.02
183.1251678	0.14
189.0909424	0.05
197.1489868	0.07
201.0461121	0.05
209.1563416	6.61
227.1283569	31.84
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	383.2279
Annotation	Unknow
Peak:m/z	Relative Intensity
127.9167633	0.06
145.9898071	0.15
171.1957092	0.03
176.8272400	0.02
177.9014587	0.02
187.2168427	0.04
187.9549561	0.11
188.7918549	0.01
189.9403076	0.01
192.0590973	0.05
205.2723999	0.02
225.9751892	0.03
251.2397766	0.10
253.0808716	0.15
253.9920044	0.10
255.3574219	0.08
259.1982422	0.06
265.3676453	0.03
269.2908630	0.03
274.1679993	0.04
277.4804688	0.10
285.0354004	0.02
291.3779907	0.02
293.3363342	0.03
296.3731384	0.02
300.0260315	0.04
302.1365051	0.06
306.8425903	0.02
309.2425537	0.75
317.0375977	0.01
319.2797241	0.09
321.1112671	0.58
321.7229614	0.07
325.2412720	0.01
327.2953491	0.36
338.1851807	0.63
339.2999268	0.19
341.4605408	0.02
346.2687378	0.07
347.3359070	0.08
348.6492310	0.06
351.4378357	0.03
355.3387756	0.02
360.2889709	0.02
363.0219421	0.03
365.2018738	100.00
365.8536072	0.21
369.8536072	0.17
373.4931946	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	626.1605
Annotation	Unknow
Peak:m/z	Relative Intensity
176.0152588	0.15
181.1685944	0.16
193.0124512	0.54
199.0810547	0.17
213.9617004	0.07
219.0322723	0.40
225.6418457	0.40
226.2581024	0.10
228.3110809	0.20
238.0171814	0.25
247.0154724	1.58
259.3983459	0.09
260.9896545	0.13
263.1478271	0.03
263.9270935	0.25
273.0075073	0.15
279.1302490	0.07
283.1772461	0.11
285.2277222	0.13
287.1725464	0.64
288.2180786	0.27
292.6661987	0.04
299.2143555	0.18
300.2200623	0.08
305.2328796	2.21
308.3359680	0.21
322.1996460	5.25
328.4032898	0.29
340.7528687	0.34
342.4649658	0.15
346.1325684	0.17
347.9682617	0.77
356.1212769	0.61
360.0079956	0.26
368.0277100	0.16
371.5474854	0.05
374.0186157	1.13
377.2508545	0.12
378.2982178	0.18
379.0576782	0.53
379.9623413	0.21
382.2965698	0.10
386.0549316	0.05
388.2402954	0.31
391.0490723	0.06
394.1449585	1.07
404.2336426	0.84
405.3098755	0.64
409.0087280	0.79
410.3792725	0.11
411.0988770	0.06
414.9961548	0.16
415.7800903	0.31
416.3838501	0.24
417.2529907	0.21
418.1563721	0.42
419.0507202	0.05
422.0026245	11.35
423.1439819	1.51
423.9843750	0.25
425.1552124	0.10
427.1812134	1.03
427.9848022	0.33
429.0296021	0.15
431.0744629	0.05
432.0543213	0.10
434.1936646	0.83
440.2227783	0.30
441.4938354	0.10
443.3117065	0.22
445.3666992	0.05
446.5997314	0.37
449.3818359	0.32
451.3241577	0.48
453.0627441	0.12
456.0957642	0.04
458.9515381	0.05
461.0826416	0.27
463.2273560	0.66
463.9506226	0.26
465.9827271	0.19
477.1082153	2.22
479.1976318	0.77
480.0551758	0.09
487.6212158	0.65
488.3907471	0.11
497.1532593	100.00
497.7604370	0.92
503.2948608	0.76
505.1461182	0.58
509.1567993	0.11
517.4594727	0.45
520.1433105	0.03
532.9879761	1.36
534.1568604	0.32
535.2476807	0.59
536.3253174	0.72
539.4380493	0.06
546.0983276	0.34
551.0761108	11.20
560.1636353	0.08
562.2224731	0.23
563.1112671	0.83
566.2630615	0.09
578.2020874	0.10
580.1699829	0.20
582.2450562	0.12
584.5514526	0.24
585.2576294	1.74
590.2952881	0.06
594.0675659	0.04
607.2675171	1.37
608.3302612	3.82
609.5794678	0.08
616.6492920	0.84
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	658.1321
Annotation	Unknow
Peak:m/z	Relative Intensity
194.3667145	0.10
199.0588226	0.20
203.1408997	0.09
209.0003510	0.09
222.9974518	0.06
225.0910797	1.48
242.9761200	0.13
250.1044006	0.14
256.6250305	0.09
261.4206238	0.35
263.1269531	0.44
267.1110229	0.11
272.5121155	0.04
274.1830750	0.15
279.0887451	4.00
287.1162720	0.36
288.0818787	0.11
289.0414429	0.15
290.9707947	0.05
297.1066284	0.21
305.1369019	2.06
309.2695312	0.09
315.0441284	0.05
317.0078125	0.06
321.0598755	0.23
322.2573853	0.04
325.1175537	0.31
330.3113403	0.09
331.9292297	0.62
332.8789062	0.51
334.1873169	0.91
335.7117920	0.26
347.9731445	0.09
354.1018066	6.08
356.1395874	0.22
359.0498047	0.18
360.3859863	0.03
371.2971191	0.06
372.0325928	0.08
374.1649780	0.11
376.3374634	0.03
378.1582642	0.52
379.9941406	0.92
392.2686768	0.09
400.1862793	0.15
406.2408447	0.49
408.5233765	0.37
409.5550537	0.17
411.3510742	0.15
414.0955200	0.13
414.9316406	0.07
416.3656006	0.17
418.0385132	0.27
419.0974731	0.07
423.4350586	0.20
426.1088867	0.32
431.2615356	0.62
433.7026978	0.55
434.3520508	0.54
435.8946533	0.88
436.7788086	0.94
440.4703369	0.05
441.5346680	0.18
449.0963745	0.16
454.0365601	12.18
455.1287231	1.98
459.1801758	0.35
459.8598022	0.21
461.2899780	0.07
477.2308960	0.38
483.2875977	0.15
485.2174072	0.32
487.3186035	0.08
488.1411743	0.34
488.9938354	0.13
491.2286377	1.10
492.4253540	0.45
493.4442139	0.09
494.3628540	0.49
495.4024048	0.86
496.4589844	0.38
503.1544800	0.28
509.1699219	2.90
510.6304932	0.27
511.3065796	0.43
512.3098145	0.03
517.3444214	0.18
519.9480591	0.35
529.1049194	100.00
529.7630615	0.36
534.4012451	0.27
535.0817261	2.19
537.0081787	0.24
538.2132568	0.40
542.1786499	0.14
546.5410767	0.11
548.2136841	0.21
552.2358398	0.17
554.8084106	0.10
560.0706787	0.28
564.9088745	1.57
566.1967163	0.33
567.4880981	0.16
569.3538818	0.07
570.3431396	0.30
573.2245483	0.03
578.1642456	0.38
583.2369995	9.91
584.4745483	0.52
595.2861328	0.85
600.7437744	0.15
601.9596558	0.06
603.6051636	0.23
610.3861694	0.19
611.0685425	0.08
614.6103516	0.03
617.0570679	1.75
622.3669434	0.45
624.4183960	0.10
628.0359497	0.30
630.6436157	0.11
640.0935669	4.38
641.1008911	0.43
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	579.1795
Annotation	N-gamma-Glutamyl-S-allylcysteine
Peak:m/z	Relative Intensity
171.2421417	1.41
172.2231750	0.20
179.1736908	0.46
180.1572266	0.01
181.2048645	0.01
195.3251343	0.00
197.2384644	0.15
198.3413086	0.01
215.2205811	1.20
216.2552185	0.13
253.1969452	0.24
254.1975098	0.02
255.2351379	0.00
271.2303162	2.04
272.2391968	0.39
273.4708862	0.01
284.4589844	0.00
289.1536255	100.00
290.0857544	11.77
291.1749268	0.33
292.3410645	0.00
323.0863647	0.00
371.5100098	0.01
387.0687256	0.01
402.9845581	0.01
416.9258423	0.00
417.7031860	0.00
448.6203613	0.01
490.2331543	0.01
519.6066895	0.00
522.6105347	0.02
540.2252808	0.00
549.3170776	0.01
560.5868530	0.05
562.0127563	0.03
563.1547241	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	842.2616
Annotation	Unknow
Peak:m/z	Relative Intensity
323.4890747	0.06
341.2026062	0.21
383.2807007	0.37
574.5935059	0.08
575.4013062	0.03
665.2701416	100.00
665.9390259	0.30
704.6803589	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	273.1456
Annotation	Unknow
Peak:m/z	Relative Intensity
82.0806885	0.05
121.1026382	0.03
127.9304810	100.00
129.2188416	0.15
141.0940552	0.09
142.0777588	0.03
142.9478149	0.03
144.1325073	1.36
167.2040253	0.02
179.0584259	0.02
185.1242371	0.07
198.3272095	0.03
210.1662598	0.02
211.3291931	0.10
213.0960999	0.17
215.1473389	0.03
228.2761841	0.06
229.1063538	0.14
233.1677551	0.09
237.2576904	2.56
243.0806885	0.11
245.1184387	0.10
255.1598816	57.60
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	165.04
Annotation	R-1-Propenyl 1-propanesulfinothioate
Peak:m/z	Relative Intensity
54.5619202	0.03
56.8957748	0.05
58.6464996	0.07
60.8111343	0.08
62.9703674	0.03
68.8397064	0.03
72.8278732	100.00
73.8511658	0.21
74.8971405	1.50
78.7741852	0.22
80.7191315	0.07
85.0740509	0.02
86.9579086	0.47
88.9520569	0.63
90.9380341	1.05
91.7627945	0.03
92.9523621	1.12
94.9609070	0.31
100.9367981	0.01
103.1120911	0.05
104.9361572	3.18
106.8879242	0.43
107.8906097	0.05
108.9574738	0.35
113.0354004	0.13
114.8306427	0.03
120.8940125	0.25
122.7749786	14.21
123.9450073	0.04
128.9214630	0.09
130.9632721	0.04
133.1351929	0.04
135.0781403	0.07
137.1774139	0.11
138.1219635	0.03
144.0186310	0.01
147.0278473	0.19
148.0201111	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	470.1071
Annotation	Tuberosinone N-beta-D-glucoside
Peak:m/z	Relative Intensity
181.2542419	0.08
189.8791504	0.02
208.9729004	0.02
211.0968933	1.23
214.5972443	0.03
218.9409332	0.03
220.247879	0.02
224.0383148	0.04
230.2485962	0.02
235.9669495	0.02
249.047699	0.02
251.0917969	0.04
260.3512878	0.03
265.1330872	0.03
266.9512329	0.03
271.3638306	0.01
272.0531921	0.04
285.2122192	0.04
286.9558411	0.05
289.0211182	0.03
290.2662964	0.08
307.227356	0.31
308.0310669	0.16
312.2018738	0.03
313.030304	0.09
322.9542236	1.44
331.2389526	0.10
332.4103394	0.16
340.2039795	2.21
341.0390625	0.49
347.9163208	0.05
351.060791	0.03
353.2060242	0.01
354.3145752	0.06
361.6030579	0.07
362.3582458	0.08
363.9609985	0.04
377.1395874	0.10
378.9239807	0.18
380.0842896	0.34
380.9860229	0.03
381.8749084	0.18
388.8096008	0.10
392.294342	0.02
393.4623413	0.02
394.2633667	0.04
396.3285828	0.10
397.3370972	0.08
411.2008057	0.18
423.6198425	0.09
424.3323364	0.03
425.3951416	0.30
428.7748718	0.02
433.0451965	0.02
433.8510437	0.01
437.483551	0.01
442.61203	0.04
452.0894165	100.00
452.9924927	0.20
460.3312378	0.36
461.124939	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	565.1973
Annotation	Unknow
Peak:m/z	Relative Intensity
162.0909729	0.11
164.2397766	0.10
179.0150757	0.12
180.0175323	0.15
197.0517883	0.59
198.2952118	0.06
214.2209473	0.24
219.9518127	0.09
231.1335449	0.21
235.0881195	0.13
236.2775726	0.08
239.1459961	2.19
242.9384460	0.25
257.1416626	2.57
257.8974915	0.08
264.0206299	0.36
266.3917542	0.05
267.9989319	0.06
271.2051086	5.03
273.1964722	0.10
275.0869751	15.32
282.2001343	0.44
285.3001709	0.06
288.1363525	0.10
289.1104736	0.78
292.8481445	0.27
293.4555054	0.12
300.0305176	0.37
302.0685425	0.16
303.1971436	0.18
308.4667969	0.17
316.1352539	0.08
317.5533447	0.17
318.3986816	0.62
321.1234131	0.21
323.2614136	0.22
326.2150269	0.39
327.4931030	0.29
331.3812866	0.38
337.0242920	0.19
342.2794189	0.86
344.1962280	3.23
353.1117554	0.17
358.2409668	0.39
362.1730347	1.10
363.9906006	0.10
373.5173950	0.23
379.2550659	0.15
382.2970581	0.83
385.3879395	0.40
386.2703857	4.17
396.9535522	0.21
400.3032227	1.36
403.4000854	12.85
404.3903809	6.16
409.3530884	0.21
414.5181885	0.59
417.0949097	0.14
418.1171875	0.35
419.2281494	0.28
421.4517822	0.29
422.4301147	0.15
423.3484497	0.07
429.3367920	7.77
430.8507080	0.05
431.8162231	0.04
436.2722778	1.91
443.2832031	0.11
447.3270264	24.19
463.4733276	0.07
467.0056763	0.19
469.1492920	0.52
470.2152100	0.12
473.3039551	14.08
477.2396240	0.27
487.3386841	0.28
489.2382202	0.25
491.2062378	100.00
491.8407593	0.27
493.1584473	0.10
494.2679443	0.05
503.1806641	0.06
504.5700073	0.74
506.1458130	0.47
508.3123169	0.12
509.5558472	0.12
511.1307983	0.12
517.5542603	0.24
519.2482910	4.99
521.4479980	7.10
523.1937256	0.43
524.3261108	0.25
529.4031982	2.27
541.5286865	2.90
547.1791382	56.53
547.7884521	0.84
548.3949585	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	289.18
Annotation	Unknow
Peak:m/z	Relative Intensity
96.9265137	0.49
110.7964859	0.11
114.0717773	28.70
127.0565491	0.34
130.0561218	0.33
144.6876221	0.07
147.8577576	0.19
149.3713989	0.14
153.0920258	0.10
155.0101624	0.07
157.1159058	0.08
160.0549622	100.00
163.2862854	0.09
166.0769653	0.16
171.0588074	0.38
172.2509308	0.07
175.2233887	0.27
180.8740845	0.11
187.0184937	0.10
188.1853333	0.15
189.1165161	0.06
193.0846252	0.03
196.2188110	0.28
197.0583496	1.02
198.2542419	0.04
200.7560120	0.11
202.9720764	0.11
207.1692505	0.05
208.9310608	0.05
213.0204773	0.07
223.9819641	0.06
226.0984192	5.32
226.8836975	0.48
228.2154541	0.04
228.9635010	0.05
229.6532898	0.13
238.9209595	0.04
242.8780518	0.50
243.8992310	0.19
245.9300842	0.02
248.1116333	0.20
253.3919678	0.68
257.8862000	0.18
259.3436279	0.11
261.2638855	0.46
266.4427795	0.34
268.1451416	0.08
271.0829468	6.16
272.2001953	24.04
280.3428345	0.96
283.2032166	0.08
294.8663025	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	518.1545
Annotation	Unknow
Peak:m/z	Relative Intensity
176.0536194	50.94
177.0520020	2.21
179.0178986	1.35
244.8926392	0.07
279.8519592	0.06
297.2016602	0.03
330.4192505	0.09
337.4052124	0.10
341.1591797	100.00
342.1978760	7.88
344.2430420	0.21
356.4282837	0.04
357.3139648	0.04
382.2395020	0.08
389.9552612	0.08
399.7301636	0.09
427.9246826	0.18
460.0363159	19.02
461.1448975	2.62
477.1647339	13.36
478.1764526	1.82
500.2372437	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	454.1301
Annotation	Unknow
Peak:m/z	Relative Intensity
132.0715332	0.04
134.7385406	0.06
140.1193085	0.03
149.0079803	0.04
161.2120361	0.13
175.1449890	0.09
177.1330261	0.05
178.8684692	0.21
186.0690460	0.09
189.1348267	0.20
204.0561523	0.34
209.0650482	0.08
213.2885895	0.05
216.8789673	0.25
227.0817261	0.04
232.1933594	0.04
233.4939270	0.16
235.1178284	2.91
250.9855347	0.88
254.3171082	0.07
259.3074646	0.33
261.2319641	0.25
267.0344543	1.50
273.1762695	0.17
277.1377563	1.64
278.4215698	0.16
280.1923218	0.34
285.4117737	0.08
293.0591431	0.03
300.1272583	0.10
305.4223022	0.04
307.2408447	0.12
308.2199707	0.25
322.0982666	0.07
325.1386719	3.84
326.2984009	0.12
330.4671631	0.56
339.2532654	0.18
346.1697083	1.57
350.2410889	0.04
351.1813354	0.04
360.0828552	0.09
360.9491577	0.06
362.2598267	0.15
364.2080078	31.10
378.2029114	0.51
379.1040955	0.54
390.0219421	0.26
392.0765381	0.70
396.2319031	7.13
399.3035889	0.03
400.7571716	0.16
404.5518494	0.03
408.4744568	0.08
410.0689087	0.11
411.2812500	0.04
413.1007996	1.18
417.3627930	0.05
418.0616150	0.29
422.4674377	0.02
436.1437073	100.00
436.8214111	0.61
437.4359436	0.05
445.0915833	0.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	332.1251
Annotation	Tryptophyl-Glutamate
Peak:m/z	Relative Intensity
113.0634842	0.22
128.0108795	100.00
129.7117920	0.08
141.9930725	0.20
153.9408722	0.10
167.1376343	1.33
177.2023315	0.19
181.3348999	0.11
187.4037933	0.31
192.2129059	0.28
203.1352844	3.88
208.2195740	0.16
235.0523071	0.09
241.0371399	0.12
242.1720581	0.19
268.2142944	0.10
286.1940002	0.05
287.2395935	0.20
288.3961792	0.17
296.1487427	0.27
314.1902161	62.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	452.1495
Annotation	Unknow
Peak:m/z	Relative Intensity
146.1676178	0.13
172.0774536	2.52
233.1420288	2.26
247.2729492	0.80
257.1469116	0.13
262.8106384	0.06
272.1671753	18.09
273.2194824	0.86
273.9809570	0.07
275.1519165	0.11
291.2869263	0.13
298.1477966	0.90
300.2168579	0.90
316.1972046	13.06
318.3362732	7.43
332.2791138	0.94
333.2321777	0.35
334.4301758	0.05
342.1261902	7.17
344.0574951	1.60
348.4857788	0.28
350.2347412	53.10
360.1206665	0.74
362.2824402	14.92
376.2016907	11.59
377.1001282	0.46
378.1495667	0.17
394.2072754	100.00
406.4210510	0.11
411.1940613	88.54
412.0760803	0.10
434.1839905	1.64
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	337.21
Annotation	Unknow
Peak:m/z	Relative Intensity
104.8617249	0.28
106.9945526	0.18
110.8760071	0.03
111.8789215	0.02
113.1580963	0.01
116.9304352	0.11
120.0138092	0.59
120.9731750	0.08
122.9354095	3.64
126.8408051	0.01
130.0365906	0.08
134.0188293	0.41
136.9811707	0.03
138.9480286	0.07
143.9989319	0.72
144.7702332	0.02
151.1069641	0.08
151.9769287	0.03
152.9305115	0.02
153.9950256	0.05
154.6290436	0.01
157.1528625	0.10
159.9547424	0.07
160.9850769	0.07
162.0433044	0.04
163.0844116	0.03
163.9756470	0.31
165.0386963	0.05
166.0873718	1.95
166.8406525	0.04
169.0069275	0.24
172.2073975	0.03
174.1793976	0.06
176.2525940	0.23
177.0357666	0.12
178.3125610	0.03
179.8283386	0.07
183.1423492	0.12
184.8518219	0.04
187.0933075	0.06
188.2880554	0.04
190.0832977	0.17
191.2507629	0.17
193.0278015	0.07
194.0321198	0.06
195.0010529	0.02
196.4475708	0.09
197.0932312	0.84
198.0397949	0.06
199.1521606	0.04
201.1382904	0.18
202.5161743	0.11
205.2171021	1.01
206.2648773	0.05
207.9523010	0.59
212.9761047	0.28
213.7911072	0.02
214.9221191	1.03
217.1380310	0.04
218.0077515	0.01
219.0160217	0.05
220.1237183	0.04
223.1069336	0.02
225.2098083	0.03
227.0881042	0.07
228.6085205	0.03
230.3967896	0.11
231.0426941	1.13
232.2680359	1.35
233.1188660	0.17
234.9417419	0.18
236.0228882	0.04
237.0839844	0.14
239.1290588	0.03
240.4118958	0.08
242.8854370	0.04
244.1073608	0.02
244.7114258	0.09
247.0737610	0.35
247.9412842	0.09
249.2310486	1.86
253.0574951	9.07
253.9475708	0.12
255.0382080	0.21
256.2514648	0.02
258.2158813	0.03
261.1230774	0.42
263.1243286	0.32
265.0460815	0.18
267.2719421	0.14
272.8928223	0.73
274.3533020	0.04
275.3815308	0.26
277.2008667	0.34
278.0902710	0.05
279.3570557	0.08
280.2206726	0.09
281.3163452	0.39
283.0274048	0.37
284.3533936	0.17
285.1028137	0.07
291.1561584	0.52
292.2563171	0.77
293.2158203	100.00
294.3741150	0.12
296.0048828	0.03
301.0708008	1.66
305.2110596	0.10
309.1733398	0.14
315.3258362	0.18
319.0348206	10.90
319.9983521	0.45
321.0200806	0.02
321.6591187	0.04
327.9295349	0.03
328.7996826	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	288.0547
Annotation	Unknow
Peak:m/z	Relative Intensity
99.9727097	0.12
110.1909180	0.05
111.0571899	0.05
124.0689240	0.15
126.1397095	0.09
127.1284409	0.16
128.0681458	0.13
140.0518799	0.03
151.9973602	0.24
154.0603943	0.54
167.9378967	0.26
170.0816650	0.34
172.0206909	0.03
179.0940704	0.06
186.1295624	3.88
187.1923065	0.04
195.9830322	61.33
198.1124573	1.26
200.1186523	0.08
201.0980835	0.12
203.1405029	0.06
207.2815552	0.08
214.1494446	3.45
216.1647034	0.03
225.6019897	0.16
226.2836609	0.05
228.2124634	0.08
229.9432678	0.56
242.1442261	2.12
244.0832520	0.25
247.0147095	5.73
252.2975159	0.02
254.1547852	1.57
259.3863831	0.04
270.0323792	100.00
272.0574951	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1069.3108
Annotation	Unknow
Peak:m/z	Relative Intensity
598.6549072	0.49
644.1275024	0.39
695.1700439	0.42
902.9207764	0.10
906.0655518	0.22
929.2188721	0.06
954.2843018	0.29
958.5495605	0.05
971.3874512	0.51
974.5400391	0.78
975.1574707	0.59
976.3696289	0.33
984.5208740	0.39
990.4458008	1.61
991.0770264	0.23
995.0559082	1.50
996.4580078	0.16
1011.2515870	1.28
1011.9978030	0.48
1033.3872070	0.32
1038.2180180	1.08
1039.0827640	0.45
1042.0585940	0.41
1047.5285640	100.00
1048.6053470	4.11
1049.3957520	0.17
1050.1694340	0.30
1051.0166020	0.60
1051.9414060	0.21
1052.7344970	0.55
1060.5108640	0.30
1110.3850100	0.51
1138.9531250	0.18
1159.8039550	1.36
1168.6623540	0.23
1220.7014160	0.28
1233.2756350	0.39
1234.3792720	1.13
1236.9836430	0.94
1330.6420900	0.27
1361.2248540	0.08
1377.5242920	0.26
1387.7648930	0.14
1400.6844480	0.26
1461.4256590	0.21
1475.5853270	0.81
1479.4886470	0.30
1506.8050540	0.11
1619.8966060	0.28
1755.3826900	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	345.1123
Annotation	Carpachromene dimethyl ether
Peak:m/z	Relative Intensity
112.0323868	0.05
127.9045258	6.29
146.7888031	0.05
184.0837708	9.17
195.8814392	0.19
197.0675964	0.18
211.1434784	0.09
214.2330322	0.40
214.9533691	0.11
223.0636902	0.05
230.1318970	0.11
237.4122009	0.09
243.0058594	0.24
252.1454468	0.11
253.1953430	0.11
257.8188477	3.45
260.2545471	0.21
271.1727295	1.79
278.9544373	0.19
281.1560669	0.06
283.2399292	0.24
289.1898499	100.00
299.2009888	1.89
301.1282349	1.07
303.0357056	0.09
304.0594788	0.51
313.1810913	0.05
317.0350952	0.04
326.2192383	0.87
327.3121338	0.87
328.5411682	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	475.22
Annotation	Phenethyl rutinoside
Peak:m/z	Relative Intensity
143.0632629	0.06
144.9554901	0.04
149.2944489	0.04
161.1204376	0.11
163.0549469	6.76
164.2099457	0.03
166.2134705	0.07
167.0380859	0.16
169.2552185	0.03
179.0017548	0.08
180.2408447	0.02
185.8561096	0.03
205.1990051	0.18
232.6541443	0.07
234.9251862	2.80
247.1543579	0.02
252.2347717	0.04
252.9497070	0.05
264.8944092	4.72
265.6006470	0.02
271.0609436	0.14
277.0670166	0.17
283.1863098	0.06
289.1755981	0.21
295.2034912	0.18
297.0839844	0.04
307.0062866	1.09
313.3927307	0.03
325.0214844	5.72
339.0559998	0.02
353.2887268	0.01
369.4081421	0.07
370.9700928	0.06
373.3657837	0.04
378.8117371	0.03
384.1875916	0.03
385.0087280	0.03
386.3844299	0.06
424.0452271	0.09
427.3603821	0.02
429.2171326	100.00
431.2696533	0.13
433.5528870	0.05
456.1545105	0.03
457.2746887	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	725.1568
Annotation	Dictyodendrin E
Peak:m/z	Relative Intensity
213.8113708	0.04
229.1053009	0.10
315.2287598	0.12
339.0267944	0.43
340.1645508	0.12
341.3674316	0.20
343.2525024	0.19
350.2365112	0.14
357.2242432	0.07
360.7781982	0.17
361.3784790	0.18
381.1204224	0.11
382.3547974	0.04
383.1442261	0.03
388.2635498	0.06
401.9918823	0.16
403.0455322	0.06
403.9330444	0.11
426.2919312	0.11
443.5224609	0.10
459.0579224	0.29
460.2803345	0.11
461.1912842	0.06
470.4786377	0.15
477.1309814	2.38
478.3193359	0.61
504.2945557	0.11
519.2319946	100.00
520.2492676	18.68
527.3726807	0.09
531.3074951	0.04
533.3195801	0.25
535.1113892	0.04
536.6154175	0.07
543.2769775	0.38
544.4550781	0.24
545.3213501	0.18
549.5581665	0.12
553.1546021	0.07
557.9938354	0.02
559.1286621	0.10
561.1741943	12.63
562.2869263	1.64
569.0995483	0.23
576.4933472	0.11
578.1838989	0.10
585.2717285	3.90
586.2730713	0.80
588.6043701	0.06
591.3093872	0.73
592.3980103	0.19
596.8264160	0.15
597.4653931	0.28
600.6900024	0.08
602.9865112	4.44
604.1392212	1.04
605.0820312	0.24
610.2709961	1.37
620.2073364	0.07
621.3076172	0.78
622.2444458	0.41
624.7495728	0.06
630.5748901	0.06
632.9756470	0.18
636.3802490	0.03
639.3159180	0.42
645.2178955	0.25
648.5870972	0.11
661.8285522	0.08
663.3023682	0.86
664.3098755	0.41
665.4376221	0.19
666.8433228	0.29
668.2756348	0.13
669.3536987	0.11
678.6588745	0.12
679.3110962	0.09
681.2175903	37.67
682.2853394	8.36
683.1937256	0.04
684.3283081	0.33
685.2606812	0.28
690.5733643	0.26
692.2988281	0.07
694.8338013	0.23
705.4637451	0.16
707.8858032	0.61
708.5148315	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	441.1964
Annotation	Unknow
Peak:m/z	Relative Intensity
132.1447449	0.11
133.7988739	0.14
146.1801758	0.47
147.0428619	0.17
149.0299530	0.23
150.1998444	0.10
162.0402527	10.34
164.1818390	1.37
179.3341675	0.06
181.2200012	0.12
185.7485962	0.07
189.1265106	0.45
203.9651184	0.46
205.1156158	0.36
206.0693970	1.61
206.7055969	0.22
213.0440063	0.06
221.1748047	2.61
223.2388611	35.84
237.3329468	0.13
243.0871582	0.13
245.2727661	0.23
246.0023804	0.04
247.2564392	0.24
247.8727722	0.15
265.1129150	70.76
267.1863708	100.00
278.4104004	0.19
279.2588501	0.21
282.1344604	0.24
307.2186279	0.11
309.0236816	0.53
312.1654053	0.12
322.3037109	0.04
325.1820679	0.12
326.1400146	0.06
333.0787659	0.14
336.3295593	0.08
345.0164795	0.05
351.3004761	0.06
352.7983704	0.14
367.3691101	0.37
370.1320190	0.09
381.3561401	0.15
383.4422607	0.13
395.3237915	0.30
397.5247192	0.07
422.1377258	0.14
423.2121887	1.52
424.4714661	0.09
427.2511597	0.04
431.8037415	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.09
Annotation	Unknow
Peak:m/z	Relative Intensity
97.0079498	0.17
99.1539230	0.41
100.8326721	3.50
107.0157166	0.18
112.9684448	12.16
115.2428131	0.15
118.9999466	9.07
124.9157867	1.43
129.0010681	0.12
130.9384003	6.39
142.9630585	12.01
146.0152893	0.07
148.4231873	0.92
149.1365356	0.91
158.9418030	0.35
160.8765564	16.06
161.5121460	0.06
178.9643555	100.00
187.1333923	0.30
224.9615784	2.15
236.9486694	3.36
239.1339722	0.48
241.0577393	0.63
248.1013489	0.59
278.1269226	0.28
281.0343323	2.57
283.1666260	1.33
295.2047729	0.85
297.3009033	0.57
298.9511719	0.22
300.0939331	25.35
322.3388062	0.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	178.0529
Annotation	Entadamide C
Peak:m/z	Relative Intensity
59.8357277	0.11
69.6557922	0.53
70.2563553	0.01
72.8494797	1.27
85.7914658	0.03
87.8634796	100.00
88.8752289	0.25
90.9037323	1.22
95.9358520	0.02
107.8791656	0.04
113.9800568	0.51
115.8421173	0.25
117.8193817	0.78
119.8517761	1.36
121.9468384	0.29
124.8422852	0.38
131.2343140	0.05
131.9045105	0.69
134.1800385	0.01
135.7473602	1.99
142.9478607	2.78
149.1751709	0.07
157.9431915	0.06
160.0366669	3.66
160.9799347	0.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	260.114
Annotation	Epidermin
Peak:m/z	Relative Intensity
85.0302582	1.62
101.0229645	3.23
128.9249268	100.00
130.0895233	5.09
136.0376129	0.04
145.2158051	0.14
149.8386841	0.26
164.3948212	0.15
168.2425232	0.08
173.0526581	0.06
174.9270935	0.04
185.0326080	0.16
186.0299225	0.09
196.1958771	1.14
198.2030792	0.22
199.2094269	0.13
215.8484802	0.74
217.2742920	0.13
242.0951996	93.86
254.8870087	0.45
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	254.0856
Annotation	Unknow
Peak:m/z	Relative Intensity
87.0139465	0.11
88.9030151	100.00
94.0850677	0.10
123.1152344	0.18
152.0378571	16.43
157.5807037	0.09
164.0665131	0.37
165.0899200	0.11
192.1658325	0.37
196.2863007	0.17
207.9557037	0.07
209.1325226	0.31
209.8901520	0.22
213.0421906	2.66
236.1942291	0.33
237.1137085	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	948.278
Annotation	Lauroyl-CoA
Peak:m/z	Relative Intensity
697.7284546	0.16
812.2537231	0.27
867.3411865	0.37
899.2249146	4.10
900.0269165	1.09
903.9553833	0.82
939.4055786	0.94
1051.4267580	0.65
1393.3709720	0.27
1799.4353030	100.00
1800.6721190	6.60
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	563.18
Annotation	Unknow
Peak:m/z	Relative Intensity
160.2836914	0.09
162.0155945	4.09
166.5057373	0.03
170.0980530	0.14
172.0951691	0.03
188.0948639	0.18
195.1567688	0.25
204.9710083	0.04
208.1788330	0.03
210.0697327	0.47
211.4102783	0.13
212.0647583	0.08
213.1282043	0.23
223.0946045	2.05
228.2163086	0.30
232.9526367	0.03
239.9383087	0.16
241.1299744	4.58
252.9914551	0.38
258.3023682	0.69
259.0465088	1.01
270.2956543	0.07
272.7023926	0.35
273.3518066	0.04
276.1759033	0.10
277.8677368	0.09
278.6237793	0.05
281.0869141	1.50
290.6311646	0.29
291.2655029	0.51
292.1643677	0.05
293.3870239	0.03
298.1840210	0.04
310.1292114	1.44
311.2695923	0.13
313.1192017	0.20
314.0491943	0.21
314.9307251	0.04
325.1223755	0.02
325.8167725	0.09
328.2792358	0.75
338.0419922	1.62
344.9263916	0.04
348.3099365	0.08
349.3698730	0.13
352.9967651	0.17
356.1564331	2.12
357.4777832	0.23
360.1491699	0.10
362.4028931	0.13
366.0795288	3.03
368.4123535	0.02
369.3068848	0.05
375.9876099	0.05
376.6466064	0.13
384.1303711	6.87
388.2977295	0.07
394.2882080	0.05
402.1487427	40.49
403.0308838	0.14
408.2383423	0.03
413.2305298	0.21
415.3338013	0.03
416.5025635	0.25
417.1716309	0.02
420.3092041	0.06
427.1361694	0.16
428.2277222	0.02
433.2892456	0.24
434.2680054	1.14
442.1655884	0.30
453.5787354	0.18
457.6431274	0.07
462.4724121	0.45
465.2609863	0.06
468.1292725	0.13
471.1741943	0.17
472.6592407	0.54
473.3809814	0.31
476.2679443	0.23
487.3955688	0.15
489.3150635	0.48
498.4295044	0.19
499.6522827	0.10
505.3671875	1.12
518.4771118	0.09
520.5664673	0.04
521.9587402	0.05
527.3378296	0.84
534.5772705	0.05
545.2807617	100.00
546.3750610	1.29
547.5209351	0.16
553.7156372	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	473.2231
Annotation	Murrafoline E
Peak:m/z	Relative Intensity
133.9823456	0.29
144.1124268	0.23
144.9654388	0.05
146.0610962	0.12
147.0741425	0.34
149.0183716	0.34
162.1696320	1.08
164.1536865	5.30
172.1865234	0.14
172.9963837	0.10
177.9712982	0.08
181.2609253	0.26
189.0831299	1.54
206.1794739	4.51
207.1551208	0.06
212.9732819	0.07
221.1642151	0.38
223.1787720	38.63
224.9877472	0.09
225.9824524	0.02
244.4475403	0.28
247.1245270	0.10
249.2590637	0.13
252.0753784	0.14
252.9857788	0.28
254.1835632	0.57
259.0870667	0.05
260.2110291	0.65
261.0698547	0.12
263.3694763	0.12
265.0912170	4.51
267.1200256	100.00
269.0259705	0.08
275.0474243	0.87
276.2772827	0.30
279.1394958	0.13
281.0945129	0.08
282.0914917	0.07
284.4679871	0.07
292.9439087	0.05
294.1918030	0.03
298.1342773	0.24
299.2816162	0.50
306.2275696	0.19
307.4733887	0.16
309.4213867	0.03
313.1986084	0.12
318.1423950	0.03
326.2201538	0.37
333.9763794	0.16
335.2314758	0.59
343.0072632	0.08
344.0162659	1.23
357.8451233	0.09
358.8631897	0.08
383.0994568	1.21
387.9879456	0.13
392.2445679	0.23
395.2667236	0.15
397.4488831	0.21
398.1944275	0.27
404.9571533	0.09
409.1765442	0.05
411.4105835	0.23
413.5660706	0.12
415.0419312	0.03
419.5630188	0.21
420.3767700	0.03
426.7197266	0.39
428.2297668	0.65
429.3735962	0.51
431.1203308	0.03
431.7258911	0.05
435.8334961	0.19
439.3600159	0.13
445.2791443	0.15
450.9560852	0.05
454.7245789	0.88
455.3830566	0.78
456.0416870	0.22
457.2984924	0.08
460.9076233	0.27
464.0470581	0.10
464.6909790	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	701.19
Annotation	Lactulose
Peak:m/z	Relative Intensity
195.0761719	0.05
221.1941376	0.06
250.8634644	0.02
323.1911316	0.14
341.1580811	0.63
377.1260376	0.22
383.2619629	0.39
394.9073486	0.02
442.7796021	0.01
443.3859253	0.02
485.3531494	1.17
503.2148438	0.42
521.2717896	0.27
539.2769165	0.50
545.1879883	0.03
588.4254761	0.03
665.2402344	100.00
666.1843262	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	194.9962
Annotation	4,6-Dichloro-3-methyl-cis-1,2-dihydroxycyclohexa-3,5-diene
Peak:m/z	Relative Intensity
58.7620277	0.36
60.9806442	0.47
70.1724014	0.10
70.8581314	0.06
72.8852310	9.72
74.9530182	0.07
77.0186081	0.03
78.9512863	3.99
80.9312592	2.39
83.0789032	0.04
84.9703217	1.57
86.8775177	0.13
88.9890976	3.55
90.9415894	2.50
93.0714874	0.16
94.6564484	0.07
96.8960571	0.09
99.0017242	0.63
100.8139648	0.08
102.9022675	9.82
104.9244385	5.56
107.1099243	0.30
110.9914856	2.30
112.8862305	50.29
114.9757385	31.85
116.7048035	0.35
118.8812256	0.33
120.8333130	6.70
122.9275665	12.51
124.9946442	0.84
125.8705444	0.19
126.9411621	0.38
128.8912048	0.97
130.0135498	0.33
131.0583954	0.92
132.3209229	0.16
132.9769135	0.90
135.0421295	0.05
136.0317383	0.11
136.9403687	2.35
137.9980774	2.68
138.8257751	1.12
142.8187408	0.36
144.0778656	0.54
145.0045776	2.86
146.0004120	0.87
147.0143433	0.12
148.9001007	0.34
150.0033875	0.10
151.0321503	0.25
152.8050842	100.00
153.8355408	0.18
161.0425262	4.79
165.1396790	0.13
167.0800323	0.40
176.9763184	2.36
178.0733032	0.56
179.0592194	0.09
195.7488251	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	224.1041
Annotation	Unknow
Peak:m/z	Relative Intensity
72.5601044	0.16
73.7751312	0.10
84.0123901	2.53
101.9252472	0.17
111.5234528	0.07
116.0368805	0.08
120.1984100	0.09
128.6096954	0.16
129.9398651	56.58
130.9855042	1.79
132.9234772	0.04
133.6852722	0.05
138.4456940	0.12
151.0655670	14.01
151.8693695	0.24
153.1783905	0.34
159.5380707	6.65
160.1901093	0.49
162.2551880	0.06
163.5935059	0.50
164.3014069	0.04
171.8315582	0.27
175.0818939	2.76
178.0477448	0.07
181.8801422	0.13
182.9967041	0.99
187.1545258	0.70
192.5261383	33.58
193.1716766	2.02
194.3407745	1.44
197.2414093	0.04
202.2507935	0.13
203.1161957	0.59
206.5072021	0.93
207.2056274	0.77
210.0758820	0.32
211.9145813	0.15
212.7397003	0.21
213.3667145	0.12
215.6373901	95.73
216.9502869	0.51
217.8950348	0.12
218.5689545	0.14
221.8523560	0.03
227.5667114	0.04
229.3391113	0.27
261.2030029	3.25
272.9896545	0.75
277.7359619	0.20
286.2590637	0.20
291.1896362	0.52
301.2517090	0.76
302.1537781	0.08
318.2160950	100.00
319.2766418	8.07
344.3120422	0.38
356.6137390	0.06
391.3448792	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	563.18
Annotation	Unknow
Peak:m/z	Relative Intensity
161.9482727	3.53
169.4166718	0.08
170.0473480	0.04
182.0183258	0.09
185.0913849	0.11
186.9943695	0.14
187.9311523	0.12
194.8690948	0.27
221.1313934	0.04
223.0826416	0.73
226.0372009	0.16
228.1224060	0.34
231.0597229	0.06
241.0016479	3.87
243.3638763	0.13
245.0043030	0.23
246.2781677	0.09
253.1224976	0.15
254.2462463	0.07
258.0836487	0.53
259.2078857	0.38
264.2191772	0.10
270.0518799	0.07
273.0978394	0.28
274.3453369	0.03
281.1422424	0.23
290.2579651	0.03
291.1251221	0.31
291.9010315	0.03
298.6345215	0.04
302.9166870	0.08
305.2343750	0.07
306.3464355	0.03
309.1073608	0.19
310.1566162	2.06
312.1724243	0.02
328.0268555	0.34
328.6273193	0.14
330.9918823	0.07
338.0621338	1.59
339.2026367	0.05
342.1118774	0.09
343.2373047	0.41
344.1583252	0.11
345.1010132	0.12
348.3775024	0.08
350.3435059	0.07
353.4753418	0.12
356.2495117	2.07
359.1043701	0.03
360.2938843	1.57
361.0758057	0.04
366.1124268	5.50
366.7674561	0.12
374.3300171	0.07
377.1786499	0.09
382.3864136	0.11
384.0946045	6.87
384.9621582	0.11
396.5607300	0.08
397.1925049	0.05
399.2716675	0.09
402.1537476	41.46
403.0095215	0.02
420.2536011	0.42
423.8059692	0.05
427.5838623	0.07
432.9920654	0.06
434.1748657	2.12
442.3538208	0.15
445.4131470	0.07
447.4410400	0.14
452.8776855	0.09
457.7097168	0.08
459.9693604	0.03
470.3171387	0.04
471.5876465	0.22
472.4826050	0.31
473.3045044	0.73
496.5197144	0.12
505.4912720	0.29
509.4486694	0.03
517.3615723	0.41
518.2907104	0.04
519.3836670	0.04
527.1459961	0.87
536.8076782	0.08
545.2579346	100.00
546.1557007	1.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	388.1888
Annotation	O-Methyltetradehydrotriphyophylline
Peak:m/z	Relative Intensity
118.1156464	0.03
136.2460785	0.02
182.1028137	0.13
203.8711395	0.01
208.1526794	0.05
226.0649414	0.06
228.9306641	0.01
230.0999451	0.02
239.0998840	0.02
254.1530151	0.03
280.2009277	0.02
298.1941528	100.00
299.0238037	0.01
313.3259888	0.02
326.0443115	0.03
347.2304688	3.01
358.0710754	0.02
370.0299072	0.07
371.2425537	0.14
378.6486511	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	689.8717
Annotation	Unknow
Peak:m/z	Relative Intensity
212.7120361	0.51
218.9716797	0.29
225.1504517	0.15
226.2208557	0.18
229.9526825	0.07
233.7996521	0.15
246.8430939	1.65
248.0247498	0.80
249.2514343	0.40
255.3404846	0.14
260.3519897	0.17
262.0153503	0.17
263.2826843	0.41
267.8760986	0.53
273.0472412	0.85
273.8841248	0.26
274.5757446	0.19
277.0231934	0.49
278.3810425	0.13
279.9315186	0.18
287.4615784	0.12
288.2864685	0.26
290.3102112	0.98
291.1614380	0.87
292.1535339	0.62
299.0494995	0.17
300.0850830	0.09
301.2419128	0.21
304.0577087	2.34
305.2651062	0.28
306.1538696	0.20
319.8673706	0.28
322.1843262	2.54
323.3498840	0.63
325.2911377	0.29
327.2534790	0.37
329.1266479	0.33
332.3916016	0.57
333.4641724	0.13
336.3479614	0.07
337.3750000	0.09
339.3947449	0.30
344.6852417	0.14
348.4544678	3.91
349.2795410	1.56
353.9926758	0.22
354.9201050	0.24
356.0112915	0.09
358.7584839	0.07
365.3480225	0.21
371.4681396	0.17
373.1943359	0.45
374.1002197	0.11
375.0014038	0.98
375.6018677	0.27
377.0543213	0.60
378.9772339	0.15
384.2360229	0.16
385.5086670	0.04
386.4627686	0.10
387.2495728	0.31
387.9430542	0.18
389.6759033	0.26
391.2361450	0.12
392.7415161	0.55
393.6889648	0.41
396.0738525	1.43
397.0874023	0.21
403.8737793	0.18
404.9545898	1.34
405.7362671	2.30
406.4761963	1.67
407.7304688	0.14
409.2004395	0.25
410.2179565	0.83
411.4970093	0.26
412.8024292	0.18
415.8190308	0.29
416.7947388	0.45
418.7559204	0.37
420.5508423	0.28
421.2722778	0.50
423.2115479	3.34
424.3994141	1.40
425.3134155	0.86
426.3292236	0.55
430.4171753	1.11
431.2948608	0.62
432.0704346	0.93
432.7525635	0.26
434.0330200	0.92
434.9920654	0.47
436.2468872	0.19
437.3665771	0.28
439.5917358	0.08
440.2517090	0.45
441.4653320	1.64
442.5815430	0.74
445.1912842	1.08
446.4305420	0.57
447.0673828	0.11
448.4092407	0.51
449.1196289	0.63
450.6374512	0.34
452.3820190	0.65
453.4747925	0.31
454.1892090	0.07
455.2097168	0.61
456.9461060	0.34
457.7391968	0.21
458.3460083	0.09
459.1013184	0.11
459.7947998	0.15
461.4019165	0.11
462.2224121	0.07
464.2520142	0.47
465.2371216	0.20
466.4263306	0.44
467.4140015	0.37
468.3646240	1.11
469.2814331	0.07
470.7647705	0.23
471.8593750	0.37
472.7606812	0.71
473.3662720	0.28
474.5184937	1.06
475.5090332	1.96
476.4235840	0.49
478.4442139	0.52
479.4026489	0.64
480.7006836	2.45
481.6304932	2.48
484.0204468	3.17
485.0119019	0.56
486.3755493	0.46
487.9882812	0.10
488.6487427	0.29
489.9848633	2.16
490.9381104	1.66
492.3708496	6.26
493.5037231	6.70
494.3377075	0.90
496.5119629	0.66
497.5907593	1.53
498.9038086	1.61
499.8355103	0.44
504.8497314	0.13
506.0794678	2.37
507.2528687	1.41
509.6315918	0.58
511.0946045	0.19
512.2893066	0.39
513.2324829	0.58
514.3366699	0.62
515.2729492	0.04
516.3247070	0.08
517.3247070	0.40
518.9727173	0.18
520.0474243	2.35
521.0626221	2.31
521.7643433	0.09
522.8389282	0.60
525.1260986	0.50
526.0636597	2.05
526.9299316	0.82
528.6830444	1.26
529.5409546	3.56
530.4381714	0.93
531.2608032	0.36
532.3369751	0.10
533.2137451	0.72
534.2089233	8.67
535.1815796	1.51
535.8433228	0.15
537.3369751	0.07
541.3764648	0.96
543.0361938	11.07
543.9756470	7.31
544.8222046	0.53
545.4929199	0.83
546.5798340	0.38
547.6755981	0.13
548.3065186	0.18
549.3624878	4.01
550.3502197	2.97
551.3200073	1.80
552.2741699	0.70
553.6865845	0.35
555.3808594	0.26
556.0679932	0.45
557.0538330	1.30
557.6771851	0.03
559.4456177	0.37
560.1163940	0.39
560.9838257	0.48
562.0544434	0.53
563.2259521	1.15
564.2952881	0.40
566.6698608	0.79
568.2501831	2.13
569.3941040	0.88
570.4153442	1.50
571.1805420	0.63
571.9680786	0.17
572.8113403	0.05
576.1825562	2.02
577.1604614	0.90
577.9230347	1.01
579.2982788	2.10
580.5613403	0.98
581.4005737	1.13
582.4553833	0.96
583.5963135	1.07
584.3642578	0.79
585.7555542	1.69
586.3969727	0.06
587.1757202	0.25
589.4375610	2.13
590.3598022	1.54
591.5618896	1.52
592.4273071	0.25
593.3317261	0.36
594.3688354	0.48
595.4004517	1.10
598.2659302	1.35
599.5480347	1.26
600.6884766	2.49
601.4254761	0.30
604.4645386	0.69
605.3526611	0.27
606.0455933	0.52
607.0557251	1.33
608.2706299	1.36
609.1979370	1.69
610.0751343	0.64
611.1322632	1.46
611.8439941	0.31
612.9421997	3.18
614.0863037	1.89
615.2020874	1.08
616.1065674	2.87
617.2163696	1.90
617.9479980	0.60
618.7075806	0.40
619.7036743	1.65
620.9318237	2.61
621.6386108	2.54
622.5881958	2.26
623.4125977	0.79
624.1156616	0.49
625.5736084	2.24
626.6646118	1.10
627.5828247	1.51
628.4782715	0.99
629.4342651	0.20
630.5184937	7.31
631.5407715	5.08
632.5643311	1.56
633.4092407	0.42
634.8781128	1.07
635.7880859	1.74
636.4265747	3.00
637.0848389	0.36
638.1213379	0.26
638.8168335	0.70
639.8745728	0.21
640.5180054	0.34
641.7139282	1.12
642.6074219	4.46
643.4185181	3.99
644.1541138	1.25
645.2365112	0.61
647.2896118	1.55
648.7996216	11.69
649.4384155	100.00
650.5369263	1.98
651.2455444	2.55
652.3710938	1.98
653.2966919	0.42
654.2550659	3.34
655.2434692	1.75
656.3901978	0.65
657.1673584	0.66
657.9650879	1.34
659.1815796	0.39
659.8761597	8.99
660.6402588	3.72
661.3875122	2.45
662.4188843	1.83
663.7437134	0.98
664.6759033	0.89
665.5090332	0.75
666.1326904	3.84
666.7444458	3.64
667.3909912	0.19
670.0319824	3.87
670.7821655	3.43
671.5583496	0.57
672.3937378	1.01
673.2587280	0.87
673.9842529	1.05
676.0173950	2.47
676.8891602	0.31
677.8434448	0.83
678.8555298	38.24
679.7890015	13.37
680.8372192	1.55
681.7738037	0.13
682.9838257	0.35
684.5278931	0.41
695.3696899	0.63
696.2434082	1.62
696.8619385	0.18
697.5053711	1.24
698.6268311	0.73
699.3023071	0.33
704.3417358	0.19
705.3311768	0.25
706.4512939	0.39
710.1619263	0.47
711.2424927	0.77
712.8201294	0.55
714.3585205	0.05
715.7079468	0.25
716.4130859	0.07
717.3554688	0.67
718.7198486	0.65
719.4997559	0.25
720.3565063	0.42
721.3737793	0.18
725.2108765	0.13
727.4476929	0.67
728.3785400	0.78
729.2023315	0.04
731.5203247	0.24
732.7217407	0.50
736.1631470	1.17
737.3024292	1.24
738.6669922	0.60
743.5493774	0.21
745.2599487	0.56
746.6429443	0.07
749.4612427	0.40
750.7325439	0.59
752.4069214	0.51
753.1450806	0.09
754.3417358	0.40
756.1048584	0.04
757.2450562	0.63
758.0236206	0.08
760.2918091	0.93
761.4085083	0.76
762.5299683	0.54
763.4436035	0.96
764.2890625	1.33
765.2723999	0.93
766.4140625	0.43
769.0545044	0.36
769.9355469	0.13
771.0631714	0.28
773.0100708	0.17
774.2308960	0.26
775.3167114	0.32
777.9003906	0.98
781.2221069	0.22
782.0767822	0.90
782.9019165	0.50
784.5261841	0.38
785.3726196	0.82
786.7449341	0.12
790.2230225	0.45
791.3113403	0.55
792.3859863	1.91
793.2822876	0.49
794.4105835	0.44
795.6319580	0.55
797.1279907	0.28
798.3649292	0.14
803.1404419	0.84
803.8463745	0.19
805.3583374	0.60
806.4731445	0.71
807.2395630	0.12
808.4353638	1.89
809.3829346	16.33
810.3610229	11.62
811.3066406	10.01
812.3762817	2.58
813.6171875	0.31
815.0311890	2.21
816.2168579	0.77
817.4300537	0.19
818.8091431	0.29
819.7133789	0.63
821.1991577	0.28
822.8457031	1.66
824.1841431	2.85
825.0787964	0.57
827.6831665	0.26
831.4024658	0.44
833.3438721	0.34
834.4185181	0.51
835.4113770	0.27
836.6367188	0.31
837.3814697	0.26
838.4212036	1.19
839.3574219	1.28
840.4921265	1.05
841.3088989	1.91
842.1238403	0.87
843.4994507	0.07
844.4699097	0.52
846.1878662	0.07
847.2841187	1.39
848.3045044	5.61
849.3841553	1.44
850.0067139	1.00
851.0834351	0.52
852.2420044	0.27
854.6200562	1.07
855.4014282	0.50
857.0241089	1.43
858.3665161	0.26
860.2736206	0.16
861.3436279	0.07
864.7875977	2.37
865.7202148	1.87
866.8651733	1.75
867.6970825	0.40
868.3740234	0.09
869.2395020	0.14
871.4970703	0.70
873.7570190	0.90
874.7749634	2.64
875.5315552	1.64
876.2992554	0.16
877.3811035	0.34
878.3984985	0.18
879.3168335	0.14
880.2349243	0.09
881.9061890	0.09
882.5382690	0.06
885.4849243	0.35
887.0986328	0.31
887.8063354	0.17
889.5934448	1.90
890.8611450	0.21
891.4900513	0.39
892.4052734	0.74
893.4792480	0.09
894.3235474	0.32
895.1881714	0.16
896.9696655	0.39
898.6372681	0.29
899.4998169	0.37
900.8674927	0.87
902.2072144	0.33
903.3738403	4.59
904.0520630	0.96
905.4016724	0.44
907.5902710	0.16
909.2953491	1.14
909.9153442	0.57
911.6472168	14.12
912.5825195	13.42
913.4021606	2.15
914.4403687	0.19
918.4472656	0.52
920.2429810	0.12
921.4711914	0.40
922.2925415	0.13
923.6508179	0.61
924.3950806	0.19
925.8593750	0.27
927.6640625	0.33
928.7619019	0.22
930.2223511	0.80
938.2188110	1.12
939.3181152	3.04
940.3496094	1.44
941.7038574	0.63
942.6320801	0.68
944.2205200	1.19
945.5164185	0.86
946.5759888	0.15
948.3374634	0.14
949.3045044	0.07
950.4845581	0.13
952.4555054	1.56
953.5556030	4.24
954.3302612	1.66
954.9983521	0.64
956.2603149	1.18
957.3999023	1.08
958.0879517	1.25
959.3557739	0.14
960.6059570	0.11
962.3154297	4.53
963.2766724	1.04
963.9144897	0.40
965.7671509	0.44
966.3996582	0.27
967.3403320	1.54
968.6347656	0.75
969.7428589	0.31
970.4645996	0.21
971.3158569	0.31
972.2990112	0.06
973.8287964	0.53
975.3173218	0.15
978.5581665	0.50
982.2171021	0.39
983.2626953	2.20
984.3356323	26.86
985.3281250	29.60
986.3413086	21.78
987.4408569	7.07
988.5464478	1.91
989.6517944	0.22
990.8060913	1.64
992.4147949	0.09
993.4040527	0.52
996.4377441	0.25
999.5449219	4.33
1000.6914060	2.43
1008.2048340	0.38
1010.5202030	0.12
1013.8887330	0.09
1017.3051150	0.49
1019.2787480	0.24
1020.4498900	0.10
1021.8002320	0.49
1024.3322750	0.13
1026.0961910	0.76
1030.3010250	0.07
1032.7923580	0.49
1036.2174070	0.24
1037.1088870	0.09
1037.7761230	0.22
1039.1269530	0.26
1040.4437260	0.27
1041.7907710	0.34
1046.3537600	0.09
1049.4854740	0.19
1053.6022950	0.09
1054.3330080	0.35
1057.4844970	0.22
1058.1453860	0.46
1060.1040040	0.18
1066.2785640	0.32
1067.4919430	0.13
1068.6433110	0.59
1069.7281490	0.91
1070.6635740	1.27
1071.4681400	0.42
1072.4877930	0.13
1077.3923340	0.17
1079.2341310	0.05
1081.1982420	0.06
1081.8939210	0.27
1082.9185790	0.76
1084.3505860	2.81
1085.3256840	9.81
1086.4649660	9.80
1087.3568120	5.17
1088.4114990	1.02
1089.4821780	0.67
1090.4479980	0.05
1092.7269290	0.10
1096.2675780	0.17
1097.0020750	0.31
1098.2750240	0.74
1099.4499510	0.13
1113.0013430	0.13
1114.0190430	0.56
1114.9852290	1.17
1115.9755860	0.57
1117.3532710	0.20
1123.8745120	0.24
1127.5544430	0.81
1129.3308110	0.20
1130.0344240	0.41
1132.0938720	1.45
1133.0817870	0.94
1137.6636960	0.26
1138.5075680	0.16
1140.4846190	0.55
1154.7503660	0.15
1187.3283690	0.42
1193.2764890	1.16
1195.4553220	0.10
1199.1748050	0.26
1200.2323000	0.18
1211.3143310	0.27
1212.4589840	0.44
1213.3458250	0.96
1214.4459230	0.17
1216.2646480	0.42
1221.5222170	0.31
1228.2404790	0.45
1229.2379150	1.70
1230.1657710	0.71
1232.7141110	0.17
1240.6046140	0.11
1242.2552490	0.16
1243.1121830	0.48
1244.5319820	0.28
1245.1982420	1.05
1245.8851320	0.04
1246.8809810	0.31
1249.1159670	0.48
1259.5073240	0.71
1260.4696040	1.70
1261.7391360	2.16
1262.6073000	0.83
1263.4779050	0.89
1265.3707280	0.06
1284.2940670	0.06
1287.5214840	0.11
1311.9726560	0.29
1313.3481450	0.06
1315.2548830	0.38
1327.2524410	0.40
1340.2423100	0.09
1354.8710940	0.18
1356.4393310	0.46
1357.7513430	0.07
1358.5056150	0.05
1359.3739010	0.06
1373.4227290	0.69
1374.4185790	0.12
1375.6074220	0.63
1376.4937740	0.61
1421.2630620	0.16
1430.2994380	0.32
1469.2204590	0.15
1490.2685550	0.19
1495.2777100	0.25
1497.4410400	0.12
1506.3044430	0.16
1518.2720950	0.12
1602.5714110	0.15
1619.5980220	0.24
1620.3736570	0.19
1792.9083250	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	623.219
Annotation	Unknow
Peak:m/z	Relative Intensity
206.9606781	0.05
281.2986450	0.09
298.4408569	0.12
307.2413940	0.08
358.2601318	0.08
359.0432129	0.10
385.2703857	0.07
403.4801025	0.15
408.3106689	0.03
430.5307007	0.18
432.9664917	0.18
434.6143188	0.15
443.3310547	0.50
447.2591553	5.58
455.7418213	0.15
457.2633667	0.09
459.2023926	0.09
460.2086792	0.21
460.9606323	0.03
474.9707642	0.11
476.7718506	0.13
489.3134155	0.12
489.9920654	0.13
491.0650024	0.06
499.2265625	0.07
500.2347412	0.27
501.3745117	0.20
502.3562622	0.36
503.0632324	0.24
507.4290771	0.17
517.2328491	0.22
527.5034790	0.09
530.1168823	0.09
533.1566772	0.17
535.0044556	0.19
541.1951294	0.05
541.8591919	1.04
556.4307251	0.09
577.2918701	100.00
578.0355835	0.49
579.2869873	0.67
588.2476807	0.49
590.3621216	0.06
603.1997681	0.14
604.2113037	0.07
605.6332397	0.48
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	454.2918
Annotation	PE(16:0/0:0)
Peak:m/z	Relative Intensity
183.8905334	0.22
193.0473938	0.04
197.5215454	0.30
198.1692810	0.14
200.9686279	0.08
208.9460449	0.06
216.1264648	0.28
217.1712189	0.08
221.1419373	0.10
259.4111328	0.13
272.9969482	0.26
279.2280273	0.12
282.3269653	1.40
297.1738586	0.03
300.5132446	0.03
308.8217163	0.13
309.4590454	0.13
313.3206482	50.05
313.9345703	0.40
331.3999939	0.04
335.7970886	0.04
338.6818237	0.03
348.1129150	0.02
356.4459229	0.32
364.0178833	0.18
364.8466187	0.15
371.1444702	0.06
387.1843872	0.10
393.1929932	2.54
407.7149353	0.27
408.8181458	0.20
411.0661316	0.07
413.3640747	0.06
418.9104614	0.22
419.5115051	0.05
422.3515625	0.05
423.1522827	0.04
436.1913757	100.00
436.8935242	0.54
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	352.1303
Annotation	Unknow
Peak:m/z	Relative Intensity
109.0397720	0.05
116.0694733	0.97
130.1486359	0.28
137.9812622	1.55
149.8971863	0.24
161.0169067	0.09
165.1498718	0.41
167.2527771	0.06
169.1268616	3.22
179.0198822	33.80
187.0343018	0.08
191.0417023	43.28
202.0005951	0.16
213.0394745	2.37
222.2803650	0.31
223.2922058	0.37
233.1996155	0.11
250.3812866	0.14
260.2252808	0.06
261.5518799	0.15
265.0712891	3.57
277.0644226	0.23
279.2468872	3.29
280.3150940	0.04
289.1685791	0.12
290.2548218	0.28
291.0707397	0.35
292.6585083	0.22
295.4097900	0.65
296.2674561	0.24
298.2754517	0.31
306.6218262	0.44
308.1781616	100.00
316.0492554	0.32
316.9730835	0.10
320.2782898	0.06
333.4709473	0.34
334.2440796	0.65
335.4757690	0.57
344.2505798	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1259.5948
Annotation	(2a,3b,5a,6a,22R,25R)-Furostane-22-methoxy-2,3,6,26-tetrol 3-[glucosyl-(1->2)-[xylosyl-(1->3)]-glucosyl-(1->4)-galactoside] 26-glucoside
Peak:m/z	Relative Intensity
449.6496582	0.02
593.8334961	0.10
611.5403442	0.83
635.2065430	0.07
707.2835693	0.04
755.5919189	0.13
773.5843506	24.33
829.5756226	0.08
851.7088623	0.13
853.7757568	0.22
869.3997803	0.74
881.6889648	0.70
917.5554199	1.11
935.4993896	19.64
936.2624512	0.07
977.8931885	0.06
1057.8612060	0.04
1078.5472410	0.24
1079.5129390	0.65
1096.9765620	5.88
1097.6046140	100.00
1139.4246830	0.12
1241.6113280	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	519.21
Annotation	Gossypol
Peak:m/z	Relative Intensity
147.0298157	12.31
197.1434631	11.15
213.0701752	4.29
267.0037231	7.48
279.381958	3.32
297.0440674	24.61
299.3746643	7.33
305.071228	2.77
322.1903687	4.60
323.3058472	8.18
326.0512085	5.49
327.1708374	24.23
357.887146	15.58
370.0790405	18.58
406.651062	11.31
421.1358032	7.67
424.8208618	8.61
428.8394165	11.49
429.4671631	17.90
438.5974121	28.60
445.4931641	13.84
457.7017212	33.58
460.2362671	10.27
462.1212158	10.19
474.5914917	17.82
476.8304443	34.31
483.0689697	19.90
486.4547729	12.61
488.0300903	6.85
491.0953369	3.38
498.2566528	9.10
500.5606079	32.81
501.1893921	100.00
502.3937378	4.29
505.5202637	17.51
509.3927002	21.99
511.3061523	16.58
516.5808105	18.88
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	466.13
Annotation	Unknow
Peak:m/z	Relative Intensity
157.0013733	1.68
159.0794067	0.27
160.0905457	0.36
166.1759033	0.30
174.8107605	0.17
188.8770447	0.85
199.0677490	0.19
217.1005249	0.46
221.2987366	0.12
229.1687927	0.26
231.1727142	0.19
233.1016846	0.60
236.2242432	0.44
244.1907654	0.30
245.0313110	0.08
247.0572205	5.43
249.3435974	0.10
251.0405884	0.10
260.9720764	0.52
262.1299438	0.07
268.2392578	0.48
276.9910278	0.16
278.9529724	16.22
281.0241394	0.35
282.6526184	0.17
286.1816406	8.56
288.4404907	0.31
289.3038025	0.37
290.2269897	0.18
300.1517334	1.11
303.9622192	0.13
315.0684204	0.17
318.2344971	1.20
319.1895142	0.24
320.1249084	0.27
326.4006348	0.13
327.1557617	1.76
333.4454956	0.35
334.6816711	0.17
337.1286926	16.92
350.1248779	0.34
358.1125488	2.56
367.1514587	1.15
368.0847778	9.67
368.8300171	0.54
370.5583496	0.10
374.1567078	0.06
376.1034546	100.00
378.1597290	0.46
384.5801697	0.19
388.5632324	0.18
390.2091370	4.14
391.5585022	0.43
403.2175293	0.15
404.3144226	0.26
407.4001465	0.42
408.2487793	8.06
411.7850342	0.42
420.4921570	0.52
421.3301392	0.48
422.0863342	0.24
425.2337646	2.72
430.0146790	0.09
431.1003723	0.10
447.1194153	0.62
448.2709656	5.71
449.4540100	0.64
454.2569885	0.27
456.7658081	0.12
469.0782776	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	452.1497
Annotation	Unknow
Peak:m/z	Relative Intensity
126.8800964	0.11
145.9014587	0.42
153.3209991	0.21
161.9395905	0.95
166.1316376	0.09
172.2159424	0.52
176.1068726	0.06
189.1409912	1.55
196.9245758	0.04
202.1168213	0.07
215.6632690	0.10
229.1755981	0.24
230.1342468	0.05
233.1607971	31.03
239.2102356	0.04
241.1758728	0.09
245.4588318	0.09
247.2099609	0.11
256.4157104	0.08
257.2274475	0.76
267.0572205	0.10
272.1481323	3.16
273.2533264	0.08
274.2395935	0.17
275.0772400	0.79
285.4688110	0.12
287.0116577	0.05
292.3695374	0.21
298.3456421	0.10
300.1575317	13.40
314.1860352	0.18
316.2824707	1.60
318.2952881	79.00
320.0437622	0.04
323.1651001	0.71
333.0624695	0.03
338.0685425	0.12
342.0635986	0.88
344.1281738	9.31
347.3229370	0.03
348.6221619	0.08
350.1699524	6.45
350.8489990	0.05
355.3637390	0.12
358.2056885	0.23
359.4727173	0.13
360.1259155	0.48
362.1561279	100.00
362.7766418	0.33
376.1366882	1.17
377.0907593	0.13
378.4310608	0.18
380.4760742	0.05
394.1368103	11.82
405.5391541	0.07
408.3944397	0.12
411.1656189	13.62
433.3651123	0.31
434.2349854	6.87
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1227.601
Annotation	Sarsaparilloside
Peak:m/z	Relative Intensity
595.4980469	0.17
665.3391113	0.00
722.4243164	0.03
739.4573364	0.08
741.5563965	0.23
755.5141602	0.02
757.6123657	3.90
759.6713257	0.00
783.5346680	0.02
841.6436768	0.02
867.6597900	0.02
883.4390869	0.04
885.5996094	0.13
901.4887695	0.21
903.5275879	22.60
904.3165283	0.05
919.5103760	4.45
920.1883545	0.03
952.1417236	0.02
975.0566406	0.01
999.1190186	0.03
1000.0213620	0.03
1001.5566410	0.01
1011.5888670	0.05
1029.6778560	0.02
1033.3519290	0.01
1046.9453120	0.12
1047.6091310	2.13
1062.9948730	0.03
1063.6323240	0.29
1065.5417480	100.00
1066.1984860	0.42
1081.5539550	1.71
1107.7700200	0.04
1123.3775630	0.03
1135.6406250	0.01
1152.7299800	0.01
1173.1925050	0.00
1186.1333010	0.01
1209.9179690	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	310.9723
Annotation	Unknow
Peak:m/z	Relative Intensity
98.8985901	0.10
106.9073486	0.10
130.1403809	0.03
142.2246704	0.07
143.0494080	0.22
157.2123108	0.06
159.1612244	0.13
167.0845795	0.28
169.2739563	0.17
173.0027161	13.42
175.0568237	0.44
183.0440979	1.45
185.2716980	0.07
195.1777039	0.25
197.1523132	0.36
198.5304260	0.09
199.4538269	0.06
201.0273590	1.56
208.1844788	0.14
209.2410583	0.08
211.2206421	0.09
212.9004211	0.04
215.2978210	0.06
216.3190613	0.11
227.2408142	0.39
229.1806030	0.25
232.8754883	0.07
234.3754883	0.11
237.2064209	0.08
239.6395264	0.33
243.5581055	0.04
245.0533447	32.95
246.8853455	100.00
247.5034180	0.32
249.2093506	0.51
250.1779175	0.10
251.3918457	0.08
264.1093750	0.05
264.9671631	0.20
266.2402954	0.18
267.3761597	0.85
275.3571167	0.09
279.2156372	0.08
292.5001526	0.46
293.3284302	4.53
295.2710571	0.33
310.3858032	0.20
311.1985168	0.41
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	426.29
Annotation	Prostaglandin E2 serinol amide
Peak:m/z	Relative Intensity
120.9543076	1.58
135.2555542	5.55
142.1101379	8.61
149.057373	3.02
152.8155823	7.07
161.3379822	1.17
162.860733	3.76
164.9633789	2.93
179.0924072	1.72
186.9564209	7.67
191.1639404	5.62
195.1237488	6.24
198.9535675	1.90
203.2422485	2.44
205.8396606	3.20
225.0159607	5.72
226.4152222	0.96
227.3887329	6.34
229.0986938	2.33
237.2580261	1.58
245.0823364	4.28
261.2733765	1.17
262.9247131	2.03
265.200592	6.03
267.0655212	2.61
270.8998413	6.35
283.4821777	3.08
297.4225464	6.82
299.0590515	0.96
304.3209839	6.56
318.599884	2.24
321.5504761	3.65
324.9580994	2.61
328.6782532	4.11
333.4682007	1.59
334.3909607	2.53
337.3804321	13.39
338.2095032	4.78
339.1589661	4.69
340.2373657	2.07
341.1062622	17.46
342.9230347	3.18
344.5979614	6.32
349.1474915	3.99
357.170105	3.67
363.1753845	2.23
366.0735168	0.86
366.8834839	4.68
371.9862976	4.68
373.0298767	3.64
376.4231873	2.00
377.075531	6.51
378.2217102	1.58
380.2078857	14.68
382.1581726	2.92
383.8678894	2.82
384.8854065	5.67
385.5313416	2.09
388.0727844	3.44
388.7233582	3.14
389.4543457	1.99
390.3912659	2.52
391.1923218	1.39
392.1152039	2.30
394.27005	3.68
395.336853	12.56
399.6011353	3.26
407.3866577	31.68
408.2782288	100.00
409.332489	40.63
410.3409729	10.55
411.1148987	2.42
417.4075317	3.60
426.9134216	7.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	223.046
Annotation	Unknow
Peak:m/z	Relative Intensity
72.7733154	0.10
82.9611053	0.03
84.8957520	9.24
96.7922516	0.02
101.0442505	0.31
110.9596252	8.68
113.0292664	0.01
125.0016785	0.33
128.9597015	1.91
131.0352478	0.02
133.1166382	0.08
134.8769073	0.05
142.9553986	0.46
145.0117340	0.03
147.0658264	0.53
149.0429535	0.02
159.0976257	0.06
161.0037384	1.01
163.2703400	0.12
169.0774078	0.05
172.9799347	0.31
179.1951752	0.10
186.9579620	2.95
187.5850983	0.01
205.0331573	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	352.0641
Annotation	Unknow
Peak:m/z	Relative Intensity
99.1522446	0.27
128.0094757	2.66
142.9957886	3.84
144.9616394	0.20
146.0519257	0.60
168.8669128	0.10
171.1092224	0.65
172.1441956	0.10
175.0726624	0.31
179.1051025	3.59
185.0737610	1.50
189.0917816	0.07
197.0032959	0.19
199.0253601	0.13
202.9409027	0.51
203.5979767	0.04
206.1423340	0.69
209.9614563	1.29
223.0896301	2.61
226.1903076	0.06
228.1426697	0.16
236.1405640	0.12
242.4736938	0.05
246.2259521	0.29
252.0659485	0.07
254.0734863	43.36
259.2338257	0.07
260.0945435	0.23
260.9270325	0.07
268.3322144	0.14
272.1045532	100.00
286.0720520	4.26
287.9496460	0.18
289.2864075	0.06
291.3869629	0.25
292.3610229	0.23
294.9279175	0.09
304.1229553	11.60
304.9928589	0.09
306.0689697	1.00
308.3631287	0.17
316.1978455	0.07
334.1387939	24.09
335.1299438	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	294.12
Annotation	Unknow
Peak:m/z	Relative Intensity
100.9444427	0.31
127.9561234	57.66
128.9839935	35.46
147.1475830	0.11
148.1263123	0.33
160.8364258	0.11
163.9122925	0.34
165.0852509	2.79
258.1291504	9.73
275.1528931	2.60
276.1144409	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	679.245
Annotation	Unknow
Peak:m/z	Relative Intensity
293.6428223	0.06
323.1387939	0.09
325.1504517	0.36
338.1176147	0.35
363.1766357	0.10
367.2977295	0.42
368.2192993	0.11
391.6101685	0.11
393.4675903	0.23
397.0369873	0.07
398.0244751	0.08
409.2965698	0.73
431.7954102	0.06
449.1011963	0.08
451.2116089	0.09
452.4694824	0.17
465.3441772	0.08
469.1907349	28.21
470.3386841	10.13
485.1944580	0.08
486.5872192	0.08
490.2969360	0.18
495.7996216	0.12
500.2310181	0.17
516.6212769	0.03
517.8140869	0.06
518.4324951	0.20
520.1524048	0.04
523.5133057	0.05
525.2281494	0.37
536.6738281	0.06
539.4761353	0.12
541.9108276	0.33
559.4270630	0.14
561.3568726	0.07
568.5238037	0.13
572.4566650	0.16
600.4358521	0.03
619.4375610	0.07
622.2698364	0.10
633.1287231	100.00
634.1415405	57.21
635.1671753	0.35
636.3272095	0.11
638.5397339	0.19
639.3936157	0.85
644.4214478	0.06
659.4913940	0.10
660.8527222	0.10
661.4797974	0.07
662.0936890	0.24
671.2088623	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	759.1782
Annotation	2'-Carboxy-4-[bis(2-chloroethyl)amino]-2-methylazobenzene
Peak:m/z	Relative Intensity
233.8021851	0.24
249.0038300	0.09
250.9922943	11.45
263.9706116	0.06
281.0521851	0.90
305.0935059	2.16
321.2913818	0.09
330.3527527	0.12
339.2140198	0.08
344.7285156	0.31
358.3044434	0.34
362.1223145	0.26
363.2156982	0.19
380.0739746	100.00
380.7022705	1.43
429.2952881	0.22
450.0519409	0.06
466.4666138	0.24
468.2540894	0.31
494.1475220	0.06
510.5423584	0.28
537.6894531	0.21
545.3184814	0.11
549.2165527	0.07
557.2420654	0.17
563.3907471	1.39
573.0033569	0.30
579.3111572	0.93
586.6307983	0.19
596.5244141	0.08
597.2714233	0.48
609.7241211	0.05
611.3610229	0.32
612.6899414	0.76
669.4812622	0.38
684.2363892	0.57
685.8867798	0.55
694.4253540	0.22
722.6101685	0.21
725.9785767	0.51
732.7285156	1.30
740.3558960	0.67
741.5809326	0.88
743.5206909	0.78
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	300.0827
Annotation	D-4'-Phosphopantothenate
Peak:m/z	Relative Intensity
98.9439163	0.02
102.8350983	0.98
109.7512054	0.05
110.9029388	2.48
121.0381012	1.92
125.9532471	0.08
128.0385284	0.12
137.9490356	0.02
144.9902039	1.68
148.1319275	0.02
151.0281677	0.12
155.0672150	0.04
155.8787231	0.02
166.9561310	0.05
167.9509735	0.03
182.1129913	0.83
188.3396149	0.04
192.9375000	0.06
195.0588684	64.30
207.9444885	0.01
209.1195679	0.08
210.1200562	0.16
210.9643555	0.12
212.2723999	0.26
215.3388977	0.07
217.2513733	0.02
217.9768677	0.02
220.2097473	0.02
222.0961609	0.02
224.0907288	0.06
226.3051758	0.05
228.0553894	100.00
228.6712036	0.11
235.2199402	0.29
237.8944397	0.04
240.1354065	0.03
242.8871460	0.04
244.5365906	0.03
252.1606750	0.07
253.9985962	0.65
254.7541809	0.12
256.4000244	0.16
259.0455017	5.02
263.0327759	0.02
265.3659058	0.14
266.4302673	0.04
268.9309692	0.09
271.4732666	0.08
276.7362976	0.36
279.5434265	0.04
281.2232361	0.69
282.2695923	0.59
283.2752075	0.40
291.2819824	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	318.2995
Annotation	Phytosphingosine
Peak:m/z	Relative Intensity
91.0315247	0.04
96.9287186	0.17
101.0209961	0.09
108.9305267	0.09
111.2906952	0.06
120.9561920	0.19
127.1282959	0.03
135.2208405	0.05
137.0661469	0.13
138.9584351	0.15
140.7299652	0.15
161.1877594	0.05
170.1536102	0.12
173.1809082	0.31
174.9589386	0.22
177.1044617	0.26
177.8562927	0.12
179.0217590	0.16
188.9633942	0.10
196.8644867	0.04
199.2212067	0.06
207.1597595	0.36
209.0668335	0.08
210.5251770	0.44
211.1779175	0.19
213.2447205	0.10
227.2414551	0.08
235.2450867	0.45
237.3243103	0.18
239.3148499	0.64
240.3007812	0.13
244.1733093	0.13
247.1363220	0.65
247.8049011	0.11
251.4919434	0.09
252.5061035	0.56
253.3472290	0.11
256.5112000	0.45
262.4993896	0.07
264.5683289	0.73
265.3742065	2.38
270.2995911	1.33
273.2156982	1.09
273.8666992	0.23
278.1073914	0.05
282.3132019	44.76
283.0511780	0.82
291.0404053	0.27
300.3229675	100.00
300.9440308	0.65
301.5560303	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	381.21
Annotation	Unknow
Peak:m/z	Relative Intensity
110.1449738	0.08
111.8103867	0.06
115.9356079	0.10
119.1802139	0.04
120.1944885	0.12
129.7984924	0.43
143.8099365	0.06
148.8558350	0.03
151.9839172	0.37
156.1923218	0.05
157.9721222	0.04
158.9147034	0.22
166.9559631	0.03
169.1254883	0.15
171.0281067	0.07
175.9798431	0.20
177.0342407	0.04
177.9280396	0.24
188.0781860	0.43
189.0446472	0.35
189.9180603	0.05
194.0662231	0.06
198.9759827	0.05
201.2896576	0.03
202.9707031	0.05
208.1646729	0.10
208.8305054	0.11
209.8780975	0.02
211.0292664	0.10
211.9808655	0.11
213.1144104	0.12
216.0564270	0.18
217.0852509	0.21
219.0788574	0.21
224.0158691	0.27
226.1816101	0.21
233.6773987	0.71
234.9461670	0.43
239.2836914	0.08
241.3884277	0.03
245.3664856	0.07
247.3841248	0.12
250.9573975	7.51
252.0353394	15.81
258.1309509	0.17
259.8272705	0.03
262.7753906	0.46
263.4329529	0.03
272.2914429	0.02
274.3532410	0.09
277.1836853	0.15
278.1240540	0.08
279.2096863	0.09
281.2294312	0.06
283.3141174	0.30
284.3558655	0.05
288.2078552	0.14
289.2420654	0.17
291.2813110	0.98
293.3153687	0.23
294.0905457	0.03
300.1356506	0.06
301.3737488	0.37
302.3160095	0.14
305.4100342	0.20
306.1678467	2.03
307.2120361	0.15
316.3583984	0.34
317.1904907	0.11
318.0568237	0.05
319.2783203	10.61
321.1124878	0.07
324.2380371	0.03
325.4536743	0.07
327.1042175	0.02
332.9234619	0.13
335.1915283	0.63
335.8824768	0.15
337.3013306	9.70
339.6265259	0.08
340.3718567	0.20
345.2795105	8.12
346.1590271	0.11
349.2837524	0.21
359.1090088	0.13
361.3558960	0.03
363.1795959	100.00
366.0853882	0.16
371.6315918	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	365.1367
Annotation	Carpachromene dimethyl ether
Peak:m/z	Relative Intensity
115.0064011	0.03
142.0614624	0.01
144.8651581	0.04
162.0946045	0.05
163.7975311	0.01
184.9708557	0.03
186.0980835	0.29
232.1320190	0.07
250.1071472	0.04
256.4833679	0.06
257.2151184	0.10
258.2911377	0.02
271.0480347	0.06
273.0850830	0.04
274.1508484	0.71
275.1156616	0.44
277.0401917	0.01
285.1960449	0.03
286.1769714	0.03
289.0135193	0.01
300.7436218	0.05
303.0021667	0.20
309.0487671	0.01
319.3016968	0.01
319.9258728	0.05
321.3754883	0.02
328.2435608	0.01
329.0525818	0.03
332.1665039	0.04
347.1556091	100.00
347.9933777	0.39
350.7040100	0.06
364.3731384	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	450.1352
Annotation	Unknow
Peak:m/z	Relative Intensity
128.0983734	0.01
139.9351349	0.05
144.2240906	0.05
170.2455444	0.02
171.9620972	0.06
174.2056885	0.01
177.0175781	0.01
185.0429688	0.06
186.2014160	0.06
191.0187836	0.13
213.0444336	0.11
214.1399841	0.40
231.0608978	9.76
233.3620148	0.06
236.9221497	0.06
244.7730408	0.16
246.2338257	0.03
255.2010498	0.04
257.7297058	0.03
259.1220703	0.07
273.0997314	2.71
302.2145386	0.06
316.1795654	0.01
321.1445312	3.60
324.2130737	0.04
342.0956116	1.07
343.1373596	0.11
360.0902710	100.00
376.1281128	0.04
385.0827637	0.02
391.0055542	0.05
392.4018860	0.30
409.1523132	0.25
414.2867126	0.06
423.9902649	0.01
431.5175171	0.05
432.1665344	0.90
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	448.1215
Annotation	Unknow
Peak:m/z	Relative Intensity
128.0057068	0.04
135.1304932	0.04
155.1406555	2.62
170.2713318	0.03
171.0129395	0.12
171.8756714	0.20
178.8327332	0.06
194.3145752	1.64
195.1597443	0.80
197.0280151	0.71
211.0706787	0.04
222.1880798	0.49
225.1214752	0.19
226.0555267	0.16
228.0507050	0.44
229.1077576	4.74
238.1903687	8.28
240.2502136	1.04
243.2878113	0.08
254.2165833	0.07
261.2313538	0.10
264.0972595	4.09
264.7768555	0.06
266.2218018	1.04
268.2049866	12.90
269.2069397	0.80
272.1149597	18.95
284.1781006	1.66
288.5056763	0.05
294.3046265	0.09
295.9372253	0.29
298.0823364	15.41
299.1255188	0.10
312.1729126	4.64
314.2312622	10.88
316.1775818	15.45
319.1488037	0.40
328.3589172	0.51
333.3021545	0.14
338.1201782	1.15
339.1098022	0.59
340.1599426	1.58
346.1212463	32.50
346.8695068	0.19
356.2904663	0.21
358.1981506	24.37
372.2121887	4.11
373.4743958	0.38
374.1469421	3.35
386.4762268	0.05
390.0838013	99.13
390.6983643	0.41
404.3919067	0.05
407.0484009	100.00
407.6670837	0.22
409.4117432	0.08
412.4044495	0.08
417.3221741	0.09
430.1293640	3.87
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	450.1351
Annotation	Unknow
Peak:m/z	Relative Intensity
142.1484833	0.02
164.0816040	0.01
188.9733582	0.06
192.0688782	0.04
212.8290405	0.12
214.0470734	1.78
220.7767639	0.02
230.9642029	9.77
244.8856201	0.05
246.1652527	0.07
255.0328674	0.08
259.2025757	0.06
263.0427856	0.67
265.2761536	0.03
268.1535339	0.06
273.1186523	3.46
275.4734192	0.05
278.9454956	0.03
286.3081055	0.07
288.2901306	0.09
291.0561523	0.02
296.9370117	0.03
303.9676819	0.84
305.2240906	0.04
316.8596191	0.02
321.1719360	9.33
324.0195007	0.09
342.1909180	1.25
346.3403931	0.07
360.1303711	100.00
360.7573242	0.21
374.2178650	0.15
387.1162720	0.20
392.1816101	5.07
409.2270813	2.20
413.9236755	0.02
431.9999390	1.14
432.7593994	0.01
433.3925781	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	680.2083
Annotation	Unknow
Peak:m/z	Relative Intensity
221.0444031	0.14
250.3761292	0.14
290.1907959	0.14
323.3295288	0.49
337.1303711	0.08
340.7703857	0.24
341.3920593	0.21
442.7852173	0.11
503.2241821	100.00
504.5241089	0.14
549.4108276	0.14
574.3508911	0.15
590.2358398	0.10
622.1151123	3.17
633.8329468	0.08
639.1555176	11.13
656.6871338	8.04
657.3925171	0.74
662.4515381	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	380.0955
Annotation	Unknow
Peak:m/z	Relative Intensity
111.1874390	0.06
125.0419159	0.08
128.0690918	4.06
135.2754822	0.04
137.1315613	0.90
138.2779999	0.28
141.0890503	0.39
143.0920410	3.97
144.0733032	0.07
145.1127014	0.24
146.0480957	0.74
152.9152832	0.16
155.1269836	7.25
156.0106812	0.73
159.9424286	0.06
161.0169983	0.18
163.1603699	0.14
166.0888977	0.10
167.0754089	1.04
169.1430664	0.19
170.1759644	0.06
171.1687012	3.20
172.1516724	0.17
173.1262207	0.13
174.1323853	0.26
174.8972778	0.81
179.0044403	7.10
180.3985596	0.05
181.1245270	0.41
182.2320251	0.17
185.0720520	1.45
187.1982117	0.35
192.0237427	0.12
192.9206085	0.11
195.0568542	0.06
197.1634521	0.45
198.0587158	0.16
199.1296387	7.89
200.4478149	1.21
201.2044373	0.93
202.3693848	0.22
203.3507080	0.09
210.0553894	3.65
211.2837677	0.11
213.1444550	5.88
214.2101135	1.08
215.2862854	0.19
217.0894012	100.00
218.1212463	7.15
222.9812012	1.00
225.5060730	0.49
226.2731323	0.25
227.2489929	0.05
228.0310059	0.06
229.2826538	0.38
231.2330322	1.06
232.3173828	0.24
234.0627441	0.17
235.9969177	0.34
238.2275391	0.27
241.2142029	1.64
242.1632385	0.24
243.2180786	0.04
246.8463440	0.08
248.9739075	0.40
251.1352234	2.82
252.2717285	0.07
254.1425171	43.50
259.2401428	21.63
260.2527771	2.39
261.3849792	0.08
263.2384033	0.08
265.0690918	0.06
266.1755676	0.06
267.1855469	0.04
272.0870361	94.76
273.3023071	1.20
277.4309692	0.04
279.2073059	0.08
283.2085571	1.09
284.1017456	0.08
286.0875854	4.19
287.1261597	0.07
288.1817932	0.34
289.1549683	0.62
290.0761719	0.37
291.2354126	0.04
292.3813171	0.10
304.2053833	12.56
305.3524780	0.46
306.2162170	0.57
307.2807007	0.12
308.4454956	0.54
313.2107544	0.06
315.3290710	0.16
317.2298584	1.68
318.4727783	0.89
319.2029419	1.41
320.3438721	0.16
323.2606812	0.68
324.3187866	0.19
333.3822632	0.80
334.1674805	0.16
335.2856750	0.66
336.3568115	0.31
337.1821289	0.51
339.2492676	0.05
340.3570862	0.21
340.9605408	0.12
343.0349731	0.14
350.2490234	0.08
361.2408752	13.88
362.1932678	22.38
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	265.0846
Annotation	N-Acetylcystathionine
Peak:m/z	Relative Intensity
89.9930496	0.34
118.9505310	69.23
129.9729919	0.94
135.8934479	100.00
148.0554047	0.25
152.6692352	0.08
182.0376740	0.05
202.0253296	1.48
217.0692596	0.21
228.9804840	0.08
230.1507721	0.10
247.0497284	1.96
248.0772095	9.93
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	411.1106
Annotation	Unknow
Peak:m/z	Relative Intensity
128.0576630	0.03
135.1116333	0.02
153.1235657	0.01
189.1583252	0.13
229.9937439	0.17
231.1038513	0.02
232.8656921	0.09
248.0243530	0.01
249.2801208	0.09
258.2097473	0.05
274.2061768	0.07
275.1369019	0.10
282.1342468	0.08
292.2116394	0.86
300.2854919	0.77
305.2800293	0.08
318.2031860	100.00
320.0670776	0.05
333.3170776	0.17
347.2929688	0.06
349.2655640	0.74
355.2819214	0.10
360.2833862	0.02
362.0866394	2.19
362.7404175	0.02
364.9611816	0.26
366.3099976	0.02
367.2105408	0.22
369.4372253	0.03
381.3643494	0.03
383.2563782	0.03
393.1784973	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	262.1281
Annotation	Epidermin
Peak:m/z	Relative Intensity
86.0017548	6.98
95.1466827	0.08
111.0099030	0.03
118.2297821	0.14
127.1378632	0.06
127.9929199	0.09
129.8184052	0.28
131.9535675	38.89
133.0097198	0.03
137.9977722	0.07
139.2606659	0.06
141.0496979	0.07
145.0431366	0.02
145.9473114	0.03
148.0112152	0.06
151.3854523	0.10
156.3220978	0.12
158.0706024	0.07
161.1614380	0.07
169.8303833	0.19
184.1721344	0.07
184.9754944	0.11
188.1334076	0.13
194.3403320	0.02
196.2780304	0.07
198.1091919	0.91
200.1079102	0.21
201.0343781	0.03
206.1575470	0.07
214.0450897	0.03
216.0450745	68.08
217.0794830	0.11
218.2297516	0.09
220.8779297	0.16
225.5943451	0.16
226.9697113	0.33
229.0325775	0.14
230.0123138	1.00
231.9577637	0.03
234.1700287	0.16
237.5927734	0.29
238.9840546	0.08
243.9824982	100.00
244.8435669	1.79
247.1720428	0.16
253.7263794	0.14
261.3654785	0.16
262.2313232	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.1144
Annotation	Unknow
Peak:m/z	Relative Intensity
289.2126465	0.02
321.0727539	0.07
341.1513977	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	372.99
Annotation	Unknow
Peak:m/z	Relative Intensity
106.9786835	0.27
110.9571304	1.98
111.9224014	2.24
112.9713135	100.00
114.9569321	50.46
119.3097534	0.82
120.8876953	0.11
126.9165344	0.64
129.0065308	14.18
130.9043732	32.31
132.8058014	0.93
135.1731873	0.37
136.8922119	7.87
138.7279663	1.10
139.3690643	0.96
141.3092194	0.29
142.9794006	3.98
144.9414673	49.89
146.9678040	5.17
150.9125519	1.37
152.1567078	0.21
153.0150452	0.89
154.8394775	1.54
158.9588318	0.69
161.0256042	7.71
162.7786102	42.27
164.7355042	0.11
168.9018250	4.83
170.8331451	0.43
171.5675354	0.37
174.7885132	1.81
176.9096680	13.03
178.2302856	0.68
178.9211731	5.76
183.0815735	0.15
183.9750061	0.26
185.0421143	1.72
187.0091705	13.52
192.9393616	2.45
194.9396210	41.65
197.0825806	0.23
200.8750153	0.39
202.8968964	2.27
203.9834290	0.14
205.2767639	0.11
206.9789124	0.59
208.9020844	1.16
217.0112000	0.69
218.3325806	3.50
218.9467468	29.32
224.6996460	0.26
226.8352051	6.42
229.2704163	0.14
234.0171204	0.18
235.0087891	0.69
249.0310974	1.51
250.1461792	2.34
250.7889099	13.87
251.5934448	0.05
258.8573608	75.67
261.0681152	0.10
264.9310303	0.09
267.0494385	69.31
267.8308716	0.94
279.0872803	0.07
281.4662170	0.90
298.9085388	12.19
323.2814941	0.24
330.9733276	3.75
340.9490356	0.72
354.6701660	0.40
355.6220093	0.33
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	468.1819
Annotation	4-Hydroxytamoxifen sulfate
Peak:m/z	Relative Intensity
147.1637268	0.03
160.9906311	0.03
174.1391754	0.04
187.1949463	0.06
196.0695496	0.13
211.9641876	0.07
212.9626617	0.06
215.1419983	0.04
217.0477600	0.09
226.3702240	0.02
229.1057129	0.09
230.1747437	0.03
243.1968689	0.01
246.0993958	0.21
249.1542664	0.17
259.3322754	0.03
262.1935425	0.15
263.8566895	0.02
269.3658447	0.01
272.2266235	0.08
273.1175842	0.09
275.0775146	0.14
281.3320312	0.12
284.2203979	0.06
286.4252319	0.13
287.3988037	0.22
288.2095337	0.02
291.1392212	0.24
304.3272705	0.11
307.1108398	0.08
307.9721069	0.02
317.4346924	0.02
320.2849731	0.09
321.1321106	0.56
327.0528259	0.03
329.1029968	0.03
338.1720886	100.00
339.0304871	0.41
346.5666504	0.09
352.4403076	0.09
363.0874329	0.21
368.1214600	0.07
370.0842590	0.04
376.1200867	0.69
377.7180176	0.78
378.3587036	1.08
389.9839783	0.02
395.1385193	0.22
403.2715454	0.14
404.2980652	0.59
406.2769775	0.03
410.3101501	0.10
421.9360657	0.26
424.3147278	0.05
425.4228210	0.05
432.0359802	0.02
434.1159363	0.25
450.2814941	9.88
451.2553406	0.04
453.8613586	0.18
467.4856873	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	840.1669
Annotation	Unknow
Peak:m/z	Relative Intensity
254.1337433	0.21
256.0309448	0.14
263.2315674	0.13
264.1943359	0.36
269.2392273	0.34
273.4954224	0.12
286.3093262	0.13
289.2150574	0.13
299.9006653	0.14
307.2872314	0.29
314.0410156	0.17
320.2148132	0.31
323.0992126	0.47
328.9372559	0.23
332.1376953	0.08
341.3330078	0.29
343.2795715	0.35
351.3162231	0.34
356.2821045	0.09
359.9210510	0.16
373.4385986	0.54
385.4362183	0.17
395.0607910	0.09
396.2269287	0.20
407.1325684	1.97
408.3582764	0.19
410.2030029	0.07
412.2634277	0.22
415.0360718	0.13
416.3841553	0.05
429.0952759	0.31
433.3136597	0.12
434.1986084	0.04
439.1807251	0.18
450.1639404	0.09
452.0103149	0.06
461.1505737	0.73
464.3051758	0.06
467.0958862	0.07
472.2722168	0.08
479.0255127	0.10
481.3528442	0.23
482.4221191	0.09
484.0842896	0.09
486.2338867	0.27
487.3410034	0.43
490.3572998	0.29
492.0376587	0.15
493.1985474	0.22
499.4428711	0.16
504.4755859	0.13
509.4224854	0.32
512.3571777	0.28
518.2622681	1.99
525.2966919	0.17
529.2509766	0.34
530.1667480	0.25
533.1156616	0.15
534.2162476	0.22
536.1649780	0.94
537.3991089	0.25
538.3938599	0.18
540.3107300	0.43
541.1804199	0.27
545.5751953	0.05
546.2639160	0.13
549.4351807	0.62
550.2404785	0.34
551.3308716	0.64
555.2016602	0.71
558.2055664	0.28
559.2877808	0.19
561.6190186	0.52
563.5435181	0.25
567.3620605	0.11
568.3224487	0.88
569.3865356	0.33
571.2910156	0.08
572.1154175	0.63
573.3439331	0.90
574.5136108	0.33
576.1885986	0.71
577.4468384	0.08
578.2266235	0.06
579.0278320	0.17
580.3239136	0.19
581.1354980	0.21
584.1981812	0.30
587.0641479	1.63
588.3450928	0.16
589.9756470	0.18
595.6962280	0.08
598.3401489	0.78
604.2988281	0.45
605.2606812	7.33
606.1918945	1.39
609.1705322	0.06
610.4704590	0.45
611.9242554	0.06
613.0523071	0.14
614.6544800	0.45
615.6177979	0.29
616.5700684	0.25
619.2291870	0.22
622.1599121	0.65
623.4326782	0.09
624.2897949	0.25
628.1027222	0.26
629.2418823	0.47
630.3527222	0.09
635.3657227	0.13
637.2084351	2.51
638.1478882	1.04
639.0007324	0.27
639.6268311	0.39
642.3950195	0.82
643.3068237	0.05
644.1708374	0.31
645.3568115	0.31
646.6776123	0.75
647.6632080	1.55
648.3450317	0.10
650.5002441	0.33
651.2295532	0.53
654.1614990	0.60
656.1309204	0.97
658.0977783	0.41
659.1454468	0.94
660.1275635	0.32
661.4456177	0.20
664.1951904	0.29
666.3555298	0.62
668.3046265	0.61
670.2803955	2.00
671.2073364	0.68
672.3662109	2.46
673.4868774	0.92
676.2797852	0.29
677.1072388	0.29
678.1724243	0.55
679.3253784	0.84
680.1927490	0.46
682.4198608	0.50
684.1420898	1.91
685.2631836	0.62
686.3621826	0.29
689.1736450	0.61
690.3204956	6.55
691.3237915	1.88
693.2053833	2.22
694.2221680	0.67
698.4336548	0.80
699.2813110	0.59
700.2113647	0.35
701.7689819	0.72
702.3745728	3.15
703.1846313	0.10
703.9223022	0.18
705.3679810	0.85
711.1041870	12.13
712.2238159	4.90
713.3313599	0.79
714.3655396	0.40
716.2102051	18.55
717.3109131	6.61
719.3324585	0.46
720.9976807	0.87
722.2673950	4.76
723.3068237	1.83
725.1350708	0.10
730.4692993	0.34
731.2952271	0.28
734.2611084	85.74
735.3306274	28.23
736.1978149	0.13
737.0213013	0.09
737.6959229	0.15
739.9653931	0.29
744.4025269	0.05
748.2188110	7.21
749.3583984	1.37
750.2395020	0.66
751.6393433	0.64
754.0608521	0.49
755.2009888	9.05
756.2764893	4.10
757.4152222	0.50
758.5175171	0.08
762.1963501	1.06
763.1546021	1.24
764.4110718	0.53
765.2173462	0.66
766.1827393	15.63
767.1311646	2.07
768.3168335	2.68
769.2113647	0.56
770.6735840	0.07
772.3967285	0.24
774.4206543	1.57
775.3007812	0.28
778.1350708	0.84
779.5274048	0.45
781.2223511	10.05
782.2912598	5.87
785.9843140	0.23
787.4282837	0.28
788.3447876	1.28
793.9873047	0.06
796.5105591	0.25
799.1324463	100.00
800.1843872	32.25
800.8682861	0.13
804.1648560	2.07
805.0400391	0.83
806.0835571	0.74
807.4024048	0.23
820.3569946	0.10
822.1005249	61.05
823.1627197	21.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	293.21
Annotation	13-epi-12-oxo Phytodienoic Acid
Peak:m/z	Relative Intensity
91.03177643	0.08
92.91056061	0.05
94.98047638	0.07
100.8378448	0.16
104.4050446	0.05
107.0224304	0.19
114.7959595	0.06
115.557251	0.06
117.0549316	0.05
119.0385437	0.08
120.7693634	0.09
123.1513519	0.18
125.2606812	0.04
128.9270325	0.12
131.0605621	0.32
132.911087	0.22
134.9156799	0.09
137.0341034	0.09
139.098114	0.04
143.1352234	0.32
144.9697571	0.34
146.9909973	0.67
149.2179565	0.08
151.0792542	1.86
153.1572876	0.07
155.1352539	0.08
156.9833984	0.49
159.0633392	0.48
161.0686646	0.45
162.1754761	0.08
163.3173218	0.55
164.1851196	0.14
165.0190277	0.05
166.8895874	0.05
169.3555756	0.02
170.2164001	0.04
171.0145264	0.18
172.9765472	0.31
173.819458	0.06
175.1236725	0.31
177.0685425	0.12
179.0255737	0.23
183.0401764	0.25
187.0145569	0.10
189.0021667	0.19
191.3543854	0.15
193.1667938	0.15
195.0825348	0.09
199.2076721	0.35
201.1838989	0.26
201.914032	0.09
203.1195068	0.21
205.2651978	0.14
207.0668335	0.19
211.2994385	0.04
213.2384033	0.06
215.2576599	0.78
217.1124268	0.39
219.1547546	0.48
219.9682922	0.02
223.197937	0.11
229.3047791	0.43
231.3190002	0.02
233.0735474	0.55
235.213501	0.53
237.0428772	0.27
239.2303772	0.83
247.1346436	0.84
248.3848877	0.03
249.3534241	0.16
251.1466064	0.34
252.7631226	0.16
257.2174683	6.10
275.2039795	100.00
276.1416931	0.06
283.973114	0.04
292.5002441	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	456.18
Annotation	Unknow
Peak:m/z	Relative Intensity
149.1484680	0.13
162.1469574	0.16
162.9708862	0.07
175.1425171	0.37
179.0111847	0.28
179.9679413	0.05
180.7500916	0.10
186.0682678	0.13
194.8515320	0.05
199.9527283	0.21
207.1327209	0.47
212.0625458	1.49
221.0603180	0.05
229.4733276	0.36
230.1588135	1.27
235.0671844	11.09
235.9933777	0.21
237.3264618	0.10
238.3204346	0.34
245.1227722	0.22
256.1912231	0.09
259.2116089	0.41
261.0968323	0.19
262.9403687	1.28
277.1391602	10.06
279.4877319	0.61
281.1672363	0.78
282.0643616	0.36
287.1901550	0.20
292.2647400	0.23
293.5625000	0.09
295.3082581	0.48
302.1878967	0.16
305.3500977	0.38
315.0122986	0.24
318.4962769	0.09
322.4168701	0.16
327.1566772	10.30
330.1797485	0.40
339.3609619	0.21
341.4479675	0.46
343.3328247	1.18
346.1565552	1.78
348.2694702	0.66
350.8520508	0.32
353.0856018	0.05
364.2255249	100.00
365.6524658	1.60
366.3223877	2.02
374.2353210	0.41
380.0514221	0.19
381.7284851	0.05
382.4018860	0.35
383.7593384	0.06
392.1770325	19.78
395.9335022	0.34
396.8602600	0.83
402.3354187	0.35
405.5456543	0.10
410.2918396	0.10
411.3323669	1.20
415.3198547	0.14
420.1693420	0.05
424.1734619	0.53
433.1842651	0.26
436.2291565	0.40
438.1336975	27.21
439.0881348	0.39
442.1412048	0.25
444.7641907	0.47
447.3461609	0.45
449.8183594	0.48
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	356.0469
Annotation	Unknow
Peak:m/z	Relative Intensity
102.0956955	0.03
104.8709412	0.03
107.7899857	0.25
113.9003296	0.15
114.8559952	0.03
118.0104599	0.03
121.9913559	0.06
122.9343796	0.05
125.9896927	1.72
127.1005096	0.05
128.1393127	0.04
136.0005798	0.02
136.9408875	1.22
158.0108643	0.11
160.0377502	2.03
175.1054077	0.03
176.0361633	0.10
176.9232330	0.03
178.9074097	7.02
184.7222595	0.04
187.9379272	0.08
189.8865662	0.08
192.0420685	1.47
194.1188660	0.06
205.3515625	0.16
208.2357330	0.15
209.3021545	0.02
210.0529938	0.15
215.9475708	0.25
218.0150452	0.14
221.2380676	0.06
223.9524536	0.44
226.0094910	0.23
227.0802612	0.05
231.9394226	0.08
234.0559387	0.18
248.6284485	0.01
249.9243774	0.64
251.2054138	0.03
255.9893188	0.26
263.9192505	0.17
265.9504700	100.00
272.2925415	0.02
276.4521790	0.10
281.9222717	1.07
283.8841553	0.20
288.3876038	0.06
289.1370239	0.06
293.2366333	0.04
295.0637512	0.02
298.0912170	3.75
302.9597168	0.07
307.3563843	0.03
309.3414307	0.08
310.3109741	0.05
311.0313110	0.06
312.7188110	0.11
313.9828491	0.06
314.8091736	0.15
320.6748657	0.07
321.2871399	0.07
322.8543091	0.18
324.1831665	0.15
326.9714966	0.10
328.6801147	0.02
337.1906738	0.71
338.4359741	0.45
339.2995300	0.05
347.2292786	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	445.1873
Annotation	Cornutin F
Peak:m/z	Relative Intensity
128.1113739	0.81
130.9565582	0.35
135.0957336	0.12
139.0887299	0.50
144.9180908	0.99
146.1367798	0.19
153.0488586	0.49
156.0399170	0.40
160.7603760	0.09
167.1635132	0.06
173.0681610	3.09
179.1131897	3.67
180.1236572	0.23
182.1423035	0.09
183.1142731	0.12
196.9611511	2.92
198.1336517	2.04
199.2398376	0.16
200.2334900	1.37
206.1885529	0.11
208.2212372	0.56
213.1548767	0.16
215.2580261	0.05
216.2364349	0.19
221.0557404	0.07
224.0769043	0.20
225.2146149	4.49
226.0336761	0.87
228.1797333	0.05
242.2473145	28.11
244.3065491	1.00
252.9645691	0.86
256.0081177	0.17
266.3244934	0.38
267.3211975	0.38
269.2423401	0.47
270.1753540	0.94
271.2251282	0.15
273.9105225	0.16
280.0152893	0.91
281.2982178	0.11
283.1791992	0.47
284.2165527	1.65
289.0609741	2.83
291.2376099	0.10
293.1385498	0.96
299.1756592	0.14
300.8974609	0.40
302.1954346	0.17
306.4042358	0.07
307.3072205	0.10
309.2567139	6.04
311.1326904	1.37
316.1998596	12.96
317.0585632	0.31
325.1909485	0.43
326.2610474	0.36
327.2881775	6.13
328.7874146	0.08
329.4588013	0.76
332.0455933	0.11
335.3125916	1.28
336.2738647	0.30
353.2709961	65.85
354.2468262	1.18
355.1360474	0.22
357.1434326	0.41
360.0455933	0.14
361.1164246	0.44
367.5276184	0.27
371.3039856	100.00
381.0454102	0.26
382.3432312	0.08
383.4057922	0.20
385.2297363	3.69
398.2899170	1.47
399.2375793	6.96
401.2290344	2.54
403.2237854	6.76
403.8539734	0.03
410.3138123	0.68
415.2801819	0.06
426.1101379	0.20
427.2134705	83.38
428.3436279	4.75
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	945.2854
Annotation	Unknow
Peak:m/z	Relative Intensity
621.2686157	0.51
743.5227051	0.28
770.7423096	0.08
783.4194946	1.00
864.2305298	2.49
867.5186157	0.40
873.8832397	0.25
878.0462036	0.41
879.2858887	0.11
900.3775024	0.57
906.2810669	0.29
944.5137329	0.88
945.3892212	0.17
1185.2531740	0.05
1191.4038090	0.58
1203.3392330	0.20
1347.2464600	0.31
1353.7398680	0.11
1354.6888430	0.09
1391.3004150	0.16
1433.8099370	0.17
1497.3477780	0.15
1510.4173580	0.32
1515.4819340	0.72
1516.4237060	0.57
1517.0897220	0.68
1527.2362060	0.32
1528.4427490	0.18
1553.3756100	1.10
1554.6917720	0.15
1567.3770750	0.13
1676.1575930	0.91
1677.5885010	100.00
1678.6937260	53.72
1689.5679930	0.11
1712.2357180	0.12
1714.2062990	0.06
1715.5067140	12.70
1716.5378420	7.57
1851.4700930	6.68
1852.6047360	4.94
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	299.0772
Annotation	Pseudolaroside A
Peak:m/z	Relative Intensity
93.0019455	2.53
111.7872543	0.23
116.985611	0.44
122.9516983	0.44
137.0212708	100.00
137.7157593	0.33
163.9344788	0.78
181.3010559	0.15
199.9399719	0.37
209.0578003	0.56
210.9936829	0.68
218.8911438	0.23
227.093689	0.43
237.065918	0.71
239.1885376	1.86
250.9162598	2.13
252.9967041	11.34
254.9293213	2.22
279.0092163	0.18
280.7067261	0.43
281.4024048	2.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.0714
Annotation	7-Hydroxy-3-Methylflavone
Peak:m/z	Relative Intensity
83.19491577	0.67
94.10134888	0.82
122.1698456	0.45
136.9499207	1.35
161.0483093	0.69
177.1098175	0.39
179.3015747	1.53
180.2142487	1.38
193.1096039	1.07
195.045578	1.97
206.154953	4.04
206.9766083	15.83
208.7486725	6.21
209.3878174	6.10
222.0108795	5.91
223.0825348	5.18
224.2472687	1.07
232.8603058	0.88
235.1121979	1.54
251.0730591	100.00
252.1262054	32.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	345.0825
Annotation	Pseudolaroside A
Peak:m/z	Relative Intensity
102.1347656	0.03
130.0008850	0.05
133.7375488	0.02
137.0375061	2.43
164.1710815	0.03
174.9043579	0.02
179.0079956	0.04
183.4616699	0.04
215.1422729	0.01
217.2298584	0.03
217.9497986	0.03
219.0110168	0.07
228.2463074	0.05
243.1929321	0.03
273.6697083	0.06
279.3865967	0.02
299.0767212	100.00
300.1636963	0.42
301.3812866	0.25
302.2520142	0.14
326.2660522	0.11
327.0958862	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	342.1345
Annotation	N-cis-Feruloyldopamine
Peak:m/z	Relative Intensity
112.9368591	0.09
119.1108704	0.08
121.9055405	0.48
123.0984955	0.09
129.9945374	0.06
133.9533997	2.41
135.0866089	2.72
136.0188599	0.27
143.0623474	0.05
144.8320465	0.06
146.2008972	0.08
148.3200378	1.18
149.1004028	6.96
150.9499817	0.16
159.0151062	0.27
160.0097961	0.38
160.7141724	0.30
161.9937439	0.73
163.3326721	0.33
165.0853882	0.04
166.2074280	0.20
175.0081177	2.49
176.0776367	2.49
177.2978363	4.26
178.0335999	15.32
180.1841431	0.45
189.1302643	0.19
189.9786377	2.75
191.2541504	0.90
192.1837158	6.24
194.1321869	0.11
202.3453369	0.14
204.0304260	1.11
204.9010925	0.47
206.0269775	0.57
207.2560883	0.14
218.1946106	0.28
222.3186951	0.15
241.3719788	0.06
246.5064392	0.07
252.3307800	0.07
253.9408264	0.32
260.8920898	0.04
264.9631042	0.05
268.9511108	0.31
271.2571411	0.06
272.2731018	0.06
280.9899597	0.05
281.6763916	0.13
283.2397461	3.29
284.1052551	1.91
285.6091614	0.09
288.1966858	0.23
292.2508545	0.24
296.1846313	0.18
297.1363525	0.30
298.1307068	1.41
299.3072815	0.86
300.1927795	0.69
304.1495972	0.08
306.0046082	0.30
308.4815674	0.12
309.1506653	2.12
312.1850586	1.76
312.8286133	0.19
314.3958740	0.11
323.1072998	1.08
324.2918091	0.68
326.0108643	6.38
327.1874390	100.00
328.2263489	2.46
342.2167664	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	581.1926
Annotation	N-gamma-Glutamyl-S-allylcysteine
Peak:m/z	Relative Intensity
170.0803528	0.72
182.0181580	0.06
205.1293335	0.10
216.0242004	0.04
227.8802032	0.04
233.9832153	0.19
245.0188293	0.07
273.0992126	0.90
274.1185913	1.66
286.3465881	0.20
291.0851746	100.00
365.3125610	0.06
419.9479980	0.13
448.3018188	0.24
450.2077026	0.09
452.1322632	0.04
491.0429688	0.11
520.3327026	0.21
562.6721191	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	458.1904
Annotation	Minocycline
Peak:m/z	Relative Intensity
156.0130310	0.20
165.1072388	0.11
166.4104919	0.09
171.7174072	0.03
174.0534668	0.18
176.0159149	0.12
177.9913177	0.16
179.0862732	0.21
182.0669556	0.84
214.0593262	0.13
229.2095337	0.21
234.8493652	0.03
244.1404724	0.19
249.1141357	0.08
259.0082397	0.68
277.2170715	10.89
281.4493713	0.05
299.5515442	0.08
311.2197266	0.27
311.9519348	0.62
315.2851868	0.09
329.1553040	100.00
329.8227539	0.25
337.2740173	0.41
339.1824341	0.03
341.2290344	0.13
342.2829590	0.15
344.3536377	0.20
350.9039307	0.21
355.8840942	0.15
362.3161011	0.25
365.8055420	0.12
370.2680054	0.06
373.0173645	0.14
382.8620911	0.14
385.1235962	0.18
395.7310486	0.29
411.0300293	0.18
412.1701355	0.06
413.4978638	0.59
414.2497559	0.17
415.6530457	0.25
422.0585327	0.16
423.1201477	0.15
424.3426208	0.30
429.1601868	0.15
435.4784241	0.20
436.8242188	0.14
437.6808167	0.05
440.0479431	3.80
441.4555359	0.45
443.0351257	0.25
447.3051147	0.34
449.0323181	0.41
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	421.0025
Annotation	SC-58125
Peak:m/z	Relative Intensity
128.7901306	0.18
130.9850464	0.05
147.2190552	0.16
155.1038666	0.10
172.7780762	1.40
176.1156769	0.19
185.9569397	0.05
186.9046936	0.03
191.0663300	100.00
199.7975769	0.06
203.0832825	0.32
213.0864868	0.04
231.0927124	0.18
233.1152039	0.04
243.0255737	0.04
246.8976440	0.09
248.0360413	10.53
255.1284790	0.10
270.9143982	0.12
272.9721069	0.14
275.0058289	0.28
286.0855713	0.09
288.8447876	1.67
291.7946777	1.03
298.0817871	0.06
299.1791687	0.04
301.9484558	0.74
306.1354370	0.03
315.8975220	0.21
317.1166382	0.75
327.3197937	0.05
331.0521851	0.04
333.2205811	0.12
334.2908630	0.01
342.6779175	0.05
359.1123047	0.19
364.1587830	0.09
376.3871765	0.07
377.2493591	0.08
380.0126343	5.36
384.9755554	0.15
386.3165283	0.02
401.9209900	0.72
403.0354614	1.73
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	299.26
Annotation	Octadecene-1,9,18-triol
Peak:m/z	Relative Intensity
93.00866699	2.84
114.8940125	1.77
143.1581421	1.35
161.1836548	0.77
167.1149902	0.62
168.9044952	0.60
171.1138306	7.70
178.72435	0.59
181.1157532	0.42
184.1665497	3.58
185.0555725	13.88
185.9561157	3.64
192.8725128	0.85
197.0828247	3.58
199.1547852	3.85
205.3440247	2.68
209.0220337	0.65
215.3302917	0.42
225.2859497	5.71
227.2324829	4.11
228.0643311	2.36
229.0706787	0.60
231.2872009	0.62
237.3218384	2.48
239.2806091	1.81
240.8642273	0.88
253.2262878	47.13
254.4401245	5.65
255.3160706	20.34
257.335022	0.49
263.2298584	15.10
264.0348206	0.49
266.7902222	0.67
269.1755371	1.19
272.3000488	0.90
278.8893738	3.17
279.500885	3.45
281.2537537	100.00
283.0932007	8.37
283.9216309	0.61
299.0973511	1.14
300.215332	0.79
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	468.09
Annotation	Unknow
Peak:m/z	Relative Intensity
131.7718964	0.13
147.0011597	0.19
162.0375671	0.08
165.1016083	0.31
169.3630676	0.47
176.9988861	1.03
184.7825623	0.36
187.0275269	0.55
193.9505310	0.33
197.0767517	0.32
202.0126648	0.11
211.0851135	5.47
214.5109406	0.39
215.2265778	0.59
217.1355743	0.07
227.1681824	0.14
228.3079529	0.11
229.8764191	0.07
234.9841003	0.08
236.0244598	1.51
239.1724548	0.17
246.8270874	0.09
262.8619995	0.20
271.1853943	0.21
285.3618774	0.26
287.2565308	0.53
288.0490417	0.17
290.2774658	0.33
291.0169983	0.13
292.0316467	0.09
293.3733521	0.10
296.9335327	0.24
301.1643066	0.44
302.4871216	0.35
303.1655884	0.50
305.0391846	0.83
309.4641113	0.19
318.9880676	1.15
321.0878906	1.73
322.0662842	2.77
323.1338501	0.05
336.9106445	6.97
337.8591919	0.15
339.0185547	100.00
340.0592651	0.74
351.1268311	0.14
353.9842834	0.64
368.5480042	0.18
374.8924255	0.71
377.3080750	0.17
378.1971741	0.41
378.9103699	0.14
380.2625427	0.29
387.6797791	0.30
390.9567566	0.07
393.1725159	20.94
396.2917175	0.06
404.8622742	0.19
406.4559326	0.38
409.1606445	0.66
410.4755554	0.31
422.1304321	0.54
423.2859802	0.22
424.3792419	0.48
427.1263733	0.19
431.9562988	0.12
435.5762939	0.75
437.8272400	0.22
450.0661926	3.98
451.2279968	1.71
459.0837097	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	424.1195
Annotation	Taveuniamide A
Peak:m/z	Relative Intensity
119.7160263	0.02
128.2664032	0.03
130.0020447	0.11
144.0672760	0.07
145.0756378	0.15
149.7564697	0.02
151.8825378	0.12
161.8971100	0.01
172.0619202	0.01
174.1470337	0.12
186.2689514	0.03
191.0812836	0.16
195.9239807	0.03
210.1051636	0.04
214.0058746	0.33
219.8980560	0.01
231.0892029	9.99
233.1694336	0.04
254.9126892	0.22
260.0284729	0.05
261.2517700	0.03
271.4335327	0.07
273.0856934	2.95
274.9630432	0.08
277.3533325	0.06
278.1866760	0.09
281.1229248	0.04
290.0946045	0.04
291.2927551	0.03
294.3699341	0.75
295.1956787	7.02
297.1231995	0.06
302.2019653	0.05
334.1853027	0.08
342.2342529	0.89
343.3846130	0.17
350.1883850	0.09
360.0884705	100.00
360.8057861	0.22
369.2243042	0.33
370.0693665	0.02
377.7149048	0.03
379.5286255	0.02
387.0318298	0.38
388.2258606	0.13
405.0903625	0.20
406.2057190	1.10
407.6098938	0.02
409.2502136	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	306.08
Annotation	Glutathione
Peak:m/z	Relative Intensity
99.0346985	0.49
113.9554214	0.26
114.6503372	0.10
115.8213806	0.07
120.0310059	0.22
123.2554932	0.10
124.8169098	0.09
128.0457764	11.09
130.0580139	0.13
130.9701538	0.07
133.1158142	0.08
135.2348633	0.10
142.9891663	8.22
145.0516815	0.10
146.0568390	0.90
155.0429382	0.06
159.9843903	11.12
161.1085052	0.14
162.0264740	0.29
165.9993439	0.07
167.1730042	0.73
169.3412476	0.19
170.0072327	0.16
171.0307007	0.30
175.0259399	0.06
176.1283875	0.11
177.1070251	10.16
179.0495605	7.52
180.8054504	0.07
182.0368500	0.11
184.9032593	1.20
186.9882507	0.29
189.0238037	0.08
197.0918884	1.75
198.0921631	0.03
199.3282166	0.10
201.1298523	0.05
203.7045593	0.17
204.3247070	0.15
204.9675598	0.24
208.3276062	0.24
210.1173096	3.66
211.3059082	0.06
212.9005737	2.29
218.3285217	0.10
219.3034363	0.17
223.9378967	0.07
226.0943298	0.79
227.0749512	0.12
228.2077637	0.55
231.0531921	1.43
236.1213989	0.39
242.1905212	2.50
243.0562439	0.15
245.3076172	0.19
249.1546936	0.22
252.2492981	0.66
254.1313477	91.37
255.6629028	0.10
262.3517151	0.09
269.1993408	0.17
272.1800842	100.00
286.0798340	0.14
287.5112610	4.25
288.1165466	66.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	402.07
Annotation	Unknow
Peak:m/z	Relative Intensity
121.0510559	0.08
128.8433685	0.13
130.9053192	0.18
131.7475281	0.21
136.9404144	0.45
139.2297058	0.13
145.2703857	0.21
149.1321411	0.09
150.9550171	0.11
153.0897064	0.29
160.9948730	0.27
163.0761414	0.57
170.6487732	0.13
178.7634277	0.19
194.8330078	0.29
199.1891327	0.05
206.8710480	0.17
211.1662140	0.25
221.9798889	0.05
226.9528198	0.09
229.1831360	0.11
239.3699036	0.08
241.2544861	0.16
243.8899841	0.12
249.3935242	0.07
251.3224182	0.19
252.2570496	0.30
254.9970093	0.09
257.4276733	0.39
261.1419067	0.14
266.9718018	2.88
271.3449707	0.11
275.3591614	0.51
281.2420044	0.10
282.4217529	0.24
283.3572083	0.12
293.1728210	0.10
294.2069702	0.07
295.0507507	0.18
296.2082520	0.28
297.0641479	0.09
302.0763550	0.08
311.6224976	1.91
312.2390137	0.91
321.2509460	0.07
325.0001831	0.16
326.9945679	0.34
328.1259155	0.19
340.0659485	0.12
341.5238037	0.82
342.2430725	0.43
343.2669678	0.46
345.2794495	0.51
346.0796509	0.40
348.9932861	0.55
352.2301941	0.12
353.8250732	0.25
356.8869934	100.00
358.8023682	0.50
361.3858948	0.99
365.2938538	0.16
370.1193848	0.47
371.2350464	0.08
373.4758301	0.66
381.2850647	0.19
383.2274780	1.66
384.2349548	1.35
385.3868713	0.27
386.2419434	0.18
388.5364380	0.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	579.1795
Annotation	N-gamma-Glutamyl-S-allylcysteine
Peak:m/z	Relative Intensity
167.0709839	0.01
171.1790466	1.51
172.1924744	0.17
179.1959686	0.47
180.1485443	0.05
197.2452850	0.18
198.0651398	0.00
215.1892395	1.18
216.2729645	0.20
253.2066040	0.25
254.1212158	0.06
271.2064819	1.90
272.2811279	0.35
273.3101196	0.01
289.1546631	100.00
290.1064453	11.43
291.1473999	0.24
375.2341919	0.00
417.5957031	0.02
418.1970215	0.00
431.4768677	0.00
536.5444946	0.02
560.8493042	0.06
562.0469360	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	299.0771
Annotation	Pseudolaroside A
Peak:m/z	Relative Intensity
92.9972153	3.90
128.0481262	0.03
136.9311829	100.00
153.0334473	0.04
160.8640442	0.05
171.2220612	0.06
179.0653687	0.08
193.1393585	0.04
199.1567993	0.09
203.0437622	0.10
207.0025635	0.14
209.1178894	0.07
212.1297302	0.21
213.0313110	0.03
220.4166870	0.02
221.3733215	0.09
239.1109009	0.22
243.3980713	0.11
253.0491638	1.30
253.6699219	0.03
254.8997498	0.08
263.0977783	0.30
280.2669678	0.04
281.2333679	0.33
282.0135498	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	349.1405
Annotation	Unknow
Peak:m/z	Relative Intensity
127.9500122	2.65
135.2984009	0.06
142.1534576	0.06
174.2574768	0.11
184.0255585	5.57
186.0474396	0.27
200.9912109	0.18
203.1382751	0.12
211.2999878	0.26
211.9711609	0.11
219.9785461	0.08
234.0798035	0.53
238.6741943	0.15
243.7978821	0.11
247.0644836	0.08
256.8431396	0.11
259.4619446	0.17
275.0113525	0.58
281.2864380	0.44
286.1545410	0.10
288.1783447	0.39
291.2340393	0.37
293.1455688	100.00
300.1966858	0.24
303.0005798	1.51
305.1465454	0.49
312.4240112	0.47
313.2532043	0.40
319.0957031	0.16
330.4395752	0.60
331.1847229	2.41
340.3648682	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	365.08
Annotation	Unknow
Peak:m/z	Relative Intensity
107.9893951	0.05
112.0450516	0.04
132.2661896	0.05
159.8670959	0.04
177.9899292	5.61
185.0288696	7.70
187.9596252	0.29
201.9668732	0.08
203.1383362	1.19
216.9693756	0.37
217.9860840	0.11
231.9848633	0.32
232.9366455	0.60
248.2099609	0.07
256.9612427	0.55
261.1406555	0.08
261.8963013	0.06
263.1261292	0.11
273.0529785	0.65
274.9975281	100.00
276.3470459	0.13
277.2718506	0.18
280.2457581	0.21
281.1242065	0.15
283.5729980	0.22
286.8456421	0.21
290.0801086	0.05
291.5296631	0.15
299.3673096	0.10
301.0056458	0.18
305.0449219	0.04
306.8971558	0.54
318.9067993	0.93
319.8336182	0.25
320.6645508	0.30
323.9876099	0.09
328.4958191	0.44
329.9217529	1.19
331.4486694	0.08
332.4855347	0.16
333.1289368	0.08
336.4726562	0.35
345.9025269	0.06
347.1929626	0.99
356.4071350	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1263.3615
Annotation	Maltopentadecaose
Peak:m/z	Relative Intensity
363.1213074	0.09
381.3742676	0.21
525.1054077	5.02
525.7402344	0.14
526.3469238	0.34
543.3082275	0.93
687.3635254	6.40
705.3383789	2.30
849.3967285	8.80
867.3793945	4.19
939.6198730	0.10
1011.4119870	7.30
1020.3862300	0.64
1029.4149170	4.50
1092.4831540	5.23
1101.4089360	26.15
1102.4851070	0.62
1103.8037110	0.08
1105.0329590	0.22
1106.2023930	0.26
1173.4204100	11.46
1174.0340580	0.12
1175.5504150	0.33
1182.4584960	100.00
1183.8571780	0.86
1185.5430910	0.28
1191.5656740	8.81
1335.3798830	8.17
1353.4508060	9.68
1354.4235840	0.16
1497.6650390	9.07
1515.5742190	11.07
1516.7391360	0.08
1617.6529540	0.26
1659.6140140	8.59
1677.5928960	14.39
1678.3509520	0.19
1821.5881350	4.69
1822.2215580	0.19
1839.5896000	15.74
1840.7087400	0.07
1983.6922610	6.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	334.0703
Annotation	N-Demethyloxysanguinarine
Peak:m/z	Relative Intensity
94.9989624	0.16
106.7739563	0.05
109.9797058	15.59
110.8797836	0.21
111.9021759	0.05
112.9279938	0.54
114.7918930	0.08
118.9904175	0.08
122.0274811	0.05
123.1024094	0.25
128.0080719	0.69
131.7602844	0.13
132.9507446	0.14
134.4087372	0.06
136.8785400	0.04
137.7898254	0.08
140.0135040	0.06
145.0444336	0.03
145.9851685	0.05
155.9894409	100.00
160.1658630	0.06
161.9418640	0.09
166.0936890	0.04
170.0829773	0.27
176.2609558	0.12
178.1029968	0.24
178.8845215	0.57
182.1281128	0.32
188.2714996	0.22
195.1987152	0.54
196.1222382	1.11
197.2114410	0.06
198.2308350	0.08
199.0494080	0.06
203.1360168	0.20
205.0203094	0.43
206.3336182	0.14
207.2036133	0.08
212.2050171	0.18
213.1015930	0.38
214.0478210	0.59
215.8429565	0.18
223.2157898	0.06
226.0142517	0.50
227.9862671	67.26
228.8298340	0.43
230.1294250	0.05
230.9810791	0.14
238.0517883	0.26
242.2756958	0.08
246.6377869	0.51
247.3478699	0.17
253.9467773	0.09
256.2942505	0.04
257.4817505	0.19
260.0506287	30.17
260.8703308	0.19
262.1553955	1.08
263.1394653	0.11
265.2658081	0.24
266.4768372	0.11
271.0507812	0.07
272.4846191	0.15
275.1594849	0.28
275.8593445	0.08
280.9503174	0.22
282.1352539	0.15
284.9670410	0.47
287.4162903	0.27
288.0563965	0.55
289.2610779	1.17
290.1849060	0.23
291.8068237	0.09
293.0111694	0.42
298.1937256	0.15
299.2811584	0.30
300.2268066	0.35
301.1785278	0.36
302.2815857	0.16
303.1325684	0.09
305.8468628	0.50
310.6101379	0.38
314.3894653	0.27
315.1184082	0.65
316.0460815	2.98
317.1089172	0.62
319.4721680	0.17
324.8171997	0.70
333.3621216	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	412.0655
Annotation	Unknow
Peak:m/z	Relative Intensity
125.1279602	0.18
130.2160034	0.14
130.9501190	0.31
136.9098816	0.37
142.6828308	0.28
143.2904968	0.29
144.6066742	0.09
151.0994873	0.03
153.1539917	0.02
155.8954926	0.19
162.2194977	0.15
170.0809326	0.06
174.1286621	1.24
175.1740723	0.12
176.8832703	0.25
179.8599243	0.98
184.0789795	0.11
189.2530670	0.05
190.9212189	0.33
193.9148254	0.14
195.0174866	0.20
196.1956482	0.14
201.1899109	0.07
204.1062775	0.05
208.8939514	8.21
209.9040222	0.14
213.2946472	0.05
215.0890350	0.03
217.1313629	0.12
219.0912476	0.35
220.0029907	0.14
221.2861023	0.11
222.3961182	0.14
223.0205688	0.05
224.3985291	0.15
227.7892303	0.05
232.0953674	0.38
236.0565491	0.05
238.0639648	0.15
240.3519592	0.05
241.2324219	0.25
242.0273743	0.13
242.8829346	0.35
245.2698975	0.03
247.9680786	0.02
248.9973450	0.51
255.2227783	0.12
261.2969971	0.11
262.4587708	0.05
263.8806458	0.47
265.0929871	0.07
266.0006409	2.08
269.3932495	0.09
273.3724365	0.31
279.3603516	0.20
280.5823364	0.19
283.0748901	100.00
291.4019165	0.06
294.0927429	0.07
299.0649109	0.07
302.2071838	0.02
305.0915222	0.37
307.5266113	0.17
309.3764954	0.05
318.9249268	0.52
321.5288391	0.29
323.5575256	0.10
325.0848389	0.03
328.4731140	0.14
331.1742859	0.08
332.0096436	0.19
333.4298706	0.18
335.4568481	0.06
336.9951782	11.69
338.1849976	0.40
339.1755981	3.45
340.2178345	0.05
343.9677124	0.05
347.2912598	0.08
349.1405029	0.96
351.4790039	0.07
353.4768066	0.19
366.0760193	0.21
366.8641663	0.36
369.5157166	0.15
374.1024170	0.02
375.9769287	0.39
393.9001465	3.44
395.0497742	1.19
402.2011414	0.13
403.0188599	0.91
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	429.09
Annotation	Unknow
Peak:m/z	Relative Intensity
173.0670929	0.07
219.0616302	0.06
223.2193146	0.06
233.4455566	0.04
248.3468628	0.10
266.1329956	0.12
283.1439819	0.04
293.4324341	0.14
295.2939148	0.05
299.1768799	0.05
300.1129761	0.05
315.5012207	0.03
316.1971130	0.31
320.2337036	0.12
323.1826172	2.87
331.5425415	0.08
333.1358032	0.23
336.1682129	0.13
340.0381470	0.20
341.2138977	0.35
348.6843262	0.04
354.4679565	0.51
355.2759399	1.94
357.2715454	6.65
360.8415222	0.08
361.4897766	0.04
364.1159973	0.05
366.7420349	0.08
367.5679626	0.16
371.0205383	0.05
382.0823669	0.05
383.1972046	0.71
384.2981567	0.44
385.2656555	0.49
388.1239014	100.00
392.8622437	0.14
395.2999878	0.11
408.7152710	0.21
410.0843811	0.53
411.0974731	1.04
420.1306763	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	224.19
Annotation	Unknow
Peak:m/z	Relative Intensity
69.0011597	0.14
83.7451782	0.13
85.8888397	0.05
93.8479614	0.54
101.0408173	0.06
105.0358429	0.04
109.8447876	0.04
121.9243011	0.08
126.1313324	0.22
134.1597595	0.04
138.7838898	0.14
140.7014313	0.09
148.0259247	0.12
150.0582428	0.22
150.9773102	0.11
151.9721680	0.07
153.2719269	0.34
156.3313446	0.06
161.1317291	0.18
162.2400665	0.18
164.2661285	0.04
166.0089264	0.10
167.0878906	0.37
167.8837585	0.08
176.6425323	0.05
178.1245117	1.39
179.0650330	0.21
180.0671387	0.60
182.8798676	14.15
186.4513092	0.21
188.0115509	0.29
189.1927032	0.14
190.2106628	0.19
191.8775482	0.09
195.9568176	1.34
200.8835602	0.89
203.2644653	0.25
206.2610931	9.79
207.1505280	100.00
207.9237671	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	680.2074
Annotation	Unknow
Peak:m/z	Relative Intensity
197.1909027	0.02
221.1265869	0.30
222.1486511	0.01
228.6296692	0.01
233.0142517	0.03
249.2792053	0.01
250.6724243	0.28
277.8749390	0.03
280.9082031	0.12
311.2375488	0.05
323.0672302	0.46
338.1731873	0.02
341.0718994	0.88
341.9753113	0.06
382.8106079	0.01
442.9057617	0.01
485.3338013	0.01
503.2856445	100.00
504.2750854	7.69
518.2015991	0.16
519.2187500	0.08
576.2583618	0.01
645.3903809	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	365.0367
Annotation	Unknow
Peak:m/z	Relative Intensity
104.6388092	0.09
110.9111633	0.12
128.9364929	0.52
151.1103973	0.08
172.9734192	9.04
174.1045532	0.13
175.3414307	0.10
178.3022766	0.08
184.8908386	0.06
197.1710205	0.13
203.1792450	0.11
219.1464233	0.76
220.0003357	0.12
223.2064819	0.08
227.4918213	0.09
228.9103394	0.18
230.7968445	0.12
234.1045532	0.27
245.0468140	6.99
246.8724976	100.00
247.5162659	0.45
258.9850769	0.31
268.9406433	0.11
273.1877747	0.07
287.9381409	0.12
289.1502686	0.17
290.0518494	0.05
291.4369507	0.11
292.4591980	1.39
293.0925903	0.02
299.1661987	0.07
303.5324097	0.13
305.1266785	0.43
311.5527649	0.20
317.4861450	0.11
318.9242859	7.95
320.0079956	0.04
321.2096558	0.23
323.4025879	0.07
329.3567810	0.15
331.5109558	0.25
337.3042297	0.11
343.9578247	0.17
345.0531616	0.05
345.9784851	0.38
347.2420044	0.95
355.7979126	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	411.1229
Annotation	Eupalinilide A
Peak:m/z	Relative Intensity
120.0196533	1.90
127.9586487	19.37
137.0621033	0.70
148.0127869	0.39
153.0821381	0.88
161.0710144	0.54
166.8898926	0.15
170.8838043	0.50
179.2015991	0.51
183.1304016	0.13
194.1644135	0.07
213.2996674	0.74
215.1231079	1.09
219.2187042	1.13
231.1026917	10.62
233.1197205	0.15
249.1596985	100.00
253.9357910	0.13
263.1862793	0.14
267.2558289	0.08
275.1718750	0.20
281.3353271	0.99
282.1564636	1.15
289.5368347	0.10
293.2837524	1.68
295.3602295	1.99
298.3695068	0.07
307.2323303	0.28
311.2670898	0.26
313.3614502	0.05
315.1983032	0.92
317.0498047	0.08
318.8944702	0.16
323.0479736	0.10
324.1917114	0.11
326.0572510	0.15
330.9647217	0.20
339.3195496	0.41
340.9407654	0.13
349.1560974	1.48
351.2190247	2.33
354.8645020	0.15
365.1279297	1.77
366.4347839	0.38
367.3852234	1.34
368.4611206	0.05
374.0243835	0.12
375.5141907	0.21
392.1725159	2.49
393.2284241	3.91
401.9317017	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	292.0496
Annotation	Unknow
Peak:m/z	Relative Intensity
85.9233627	0.73
86.8949738	0.42
96.0077057	0.29
109.1272430	0.34
114.2298737	0.05
115.0309296	0.41
119.2790222	0.26
123.1443481	0.18
123.8540421	0.71
127.1018982	0.49
140.1074829	4.71
145.9115906	0.07
156.0627747	0.44
157.9510803	1.21
158.9358521	0.25
161.0895996	0.06
162.0540466	0.79
166.0666962	0.25
167.8021851	0.11
172.0986786	3.89
176.0296021	8.41
184.0703583	3.69
185.1287689	0.18
187.9559631	0.47
190.0076294	4.53
193.9960632	0.20
202.0023499	47.62
216.1065674	0.98
218.0738220	0.18
230.0436707	0.13
231.9423218	0.34
234.0524292	40.45
242.1506958	0.38
247.0462036	0.27
251.0801697	9.62
256.1616821	0.21
271.9573364	0.11
274.0238037	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	378.0797
Annotation	2'-Carboxy-4-[bis(2-chloroethyl)amino]-2-methylazobenzene
Peak:m/z	Relative Intensity
111.0760193	0.07
127.9789810	2.58
140.9618530	0.37
142.9946899	3.14
146.1025085	0.33
150.9146118	0.04
153.2405396	0.19
159.3214569	0.07
159.9922943	0.44
162.2911987	0.09
167.1444550	0.05
168.9893188	0.08
171.1722412	0.13
175.0543518	1.57
177.0982208	0.80
179.0856323	3.20
180.8698425	0.27
182.8219604	0.02
185.0259857	1.40
192.1240540	0.07
197.0242004	1.30
198.0384216	0.20
203.0862732	0.42
210.1608887	1.54
211.1052856	0.07
214.1229553	0.12
215.2431641	0.31
226.1698608	0.52
228.1646118	0.45
228.8338013	0.12
236.2507935	0.08
242.1144714	0.20
248.9994812	0.73
252.1348877	0.34
254.1822510	24.20
260.3924866	0.10
262.3313599	0.05
268.1982117	0.29
270.0948486	0.16
272.1617432	91.88
283.0349121	0.04
286.1665955	17.09
288.1987610	1.40
300.2272339	0.09
304.1318359	100.00
306.2062988	4.70
310.3431091	0.07
325.8974915	0.08
331.4183044	0.03
333.6326599	0.06
335.5298157	0.20
343.4476929	0.05
360.1637268	16.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.09
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
76.73927307	1.13
78.96804047	0.93
82.94593048	3.67
90.72680664	1.34
92.96756744	1.10
94.91876221	3.01
97.13708496	3.13
98.03764343	0.94
100.8472595	1.84
106.7702637	0.30
111.0353088	2.76
112.9577637	1.67
115.0648956	0.91
118.0129395	2.37
121.0151062	3.16
122.9991302	6.87
125.0092773	3.01
127.0902557	1.27
128.9239044	10.92
130.1369019	3.63
135.1391449	2.72
137.0987549	7.92
138.9525452	0.73
141.1029205	3.31
144.9029236	3.37
147.1013336	0.89
149.0069885	2.50
151.0556641	86.72
152.0557404	2.40
152.9522858	8.75
155.0074615	6.80
157.2235718	0.61
159.014801	3.17
162.1279449	0.85
163.0344849	15.04
165.0301361	5.16
166.9923248	3.56
169.1957855	4.03
175.1632843	0.61
178.9606476	0.67
181.2502136	0.92
185.008316	4.53
189.1740875	0.67
193.0135803	3.49
194.9415894	6.83
197.0198822	14.65
198.0246277	1.22
199.2896271	5.10
203.3289948	1.67
205.173172	1.99
207.0113678	10.31
209.110672	8.61
210.8117523	9.78
217.1654816	30.82
218.3820496	0.61
221.1486816	3.15
224.6626282	3.78
225.3411102	11.78
232.3782349	4.24
233.1726074	2.98
235.1833038	70.23
236.1364136	0.88
238.1425171	11.48
239.0942383	1.78
251.0032501	0.82
253.0802002	100.00
254.3203583	4.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	178.0529
Annotation	Entadamide C
Peak:m/z	Relative Intensity
69.5671310	0.36
72.8843994	0.41
87.8645935	100.00
88.9376602	0.04
90.9700470	0.39
113.9649048	3.17
114.9125214	0.02
117.1472931	0.10
117.9378510	0.26
119.8686218	0.19
122.0384521	0.08
124.9969330	0.04
132.0034485	1.56
135.8560638	0.77
142.8808441	1.36
145.2130432	0.02
159.9693298	22.87
161.0331421	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	579.3884
Annotation	Timosaponin A-I
Peak:m/z	Relative Intensity
167.1621704	0.71
168.9571381	0.11
171.2893677	0.16
184.7241364	0.18
191.1971283	0.15
199.3078308	0.24
204.1072083	0.03
210.4329529	0.03
211.3375549	0.20
212.8913879	0.11
215.2806396	0.08
221.0862274	0.09
241.2241058	0.13
250.2118073	0.09
250.9713898	0.04
255.1560059	6.66
257.0526428	0.07
269.3796082	0.15
271.2332458	0.11
273.302002	45.31
285.2609863	0.23
287.2092896	0.13
289.3403931	0.17
296.6416016	0.09
298.1569824	0.14
299.2227478	0.07
303.1307983	0.10
304.2686157	0.24
309.173584	0.18
310.477356	0.24
311.1019897	0.65
311.9484558	0.13
321.4633789	0.62
322.2615967	0.09
323.3867798	0.12
331.2915649	0.71
372.1845093	0.10
378.9082642	0.08
381.361084	0.55
385.1991577	0.11
397.1942139	0.17
398.4360352	0.18
399.4573364	1.59
401.3151855	0.29
403.2155762	0.08
413.380249	0.39
415.3201904	0.26
417.3282471	100.00
418.0071411	0.18
425.7177124	0.08
427.4797363	0.08
429.225708	0.04
435.2550659	2.05
440.1367798	0.13
440.9904785	0.06
442.3158569	0.12
446.0733032	0.04
447.1536255	0.18
448.1621094	0.07
450.083374	0.14
458.5730591	0.10
468.0407104	0.06
475.6506348	0.15
483.7252808	0.10
486.1760254	0.17
487.4271851	0.12
488.378418	0.34
489.3530884	0.72
492.3838501	0.18
498.0501709	0.39
507.2514038	0.34
515.2724609	0.18
525.5370483	0.72
534.3753052	0.10
535.7510376	0.08
543.4154663	1.85
544.276123	0.04
561.3516235	3.94
569.6477661	0.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.1144
Annotation	Lactulose
Peak:m/z	Relative Intensity
113.1214600	0.02
126.0565033	0.05
172.1433411	0.03
207.0523376	0.14
224.0941162	0.04
255.1428223	0.04
262.0901184	0.03
271.2861328	0.12
282.2250671	0.01
289.2248840	2.86
341.1552734	100.00
341.7605591	0.12
368.1486816	0.09
369.4522095	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	261.15
Annotation	Cordiaquinol J
Peak:m/z	Relative Intensity
92.84902954	0.13
128.7141571	0.15
141.0488281	0.35
142.863205	0.37
146.007019	0.11
180.9627838	0.26
182.9049835	0.14
189.188858	0.32
197.0125275	0.08
199.6005402	0.21
200.3903198	0.18
214.9743958	4.90
217.0028839	3.02
218.1260529	0.08
220.2635345	0.11
225.0610199	0.52
226.920929	0.25
228.9113922	0.12
233.1016083	0.20
234.0023041	0.11
243.1347656	100.00
244.026474	0.65
245.3236084	2.87
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	369.15
Annotation	U50488
Peak:m/z	Relative Intensity
106.1062622	0.20
108.0021896	0.11
114.1755600	0.08
116.0551605	0.20
119.0815048	0.04
120.3581161	0.08
121.1023331	0.94
122.0503540	0.24
128.1799469	0.12
130.0833435	0.39
130.9380493	0.11
134.1353455	0.32
134.9791718	0.07
136.1033325	8.07
136.9960938	0.03
139.1333008	0.04
142.0522766	0.24
145.0776062	1.11
147.1919098	0.40
150.9685364	0.06
154.1628418	0.63
155.0740967	0.18
157.6902771	0.05
158.3229218	0.06
162.0788574	5.39
163.9488831	0.54
169.2691650	0.05
173.5407410	0.05
174.2135925	0.17
175.0003357	0.24
176.9824371	0.06
178.1880493	0.06
179.1546936	0.06
180.1212616	0.29
181.1510010	0.04
182.0595245	0.54
183.0139618	0.05
184.2569275	0.04
185.0216980	0.10
186.3030090	0.09
187.0625610	0.12
188.0456543	1.71
190.0204468	0.13
194.0710297	0.14
195.1260071	0.10
197.3511658	0.11
201.0992889	0.06
202.0778198	0.79
204.1724701	0.29
205.3572083	0.12
206.1347351	0.08
208.1968079	100.00
210.3030396	0.33
213.3312988	0.04
214.8499603	0.04
216.2233734	0.05
217.4337006	0.10
220.3067017	0.72
221.3290405	0.14
222.4393005	0.08
223.2822876	0.08
224.9535217	0.31
226.1495361	0.36
227.1264038	0.08
228.1263733	1.67
230.1940613	7.73
231.3040466	0.05
232.1989441	0.15
233.9780579	5.35
234.5928650	0.01
235.8747559	0.04
237.1342468	0.09
241.1969299	0.03
242.2008972	0.57
243.3491516	0.08
245.1066589	0.04
248.1980896	85.66
249.1359558	0.32
250.2658386	0.21
252.9915771	0.05
255.0025940	0.05
256.0881348	0.02
257.0617371	0.09
263.1546631	1.02
264.1858215	0.07
266.2547302	1.22
267.1636353	0.06
269.3611755	0.18
274.1496277	21.25
276.4976196	0.06
277.3857422	0.18
278.7746277	0.07
280.4194946	0.11
281.2140198	0.30
283.0724487	0.17
285.8813477	0.10
286.8283386	0.10
287.4527588	0.27
288.3203125	0.42
289.1768188	0.07
290.9999084	0.07
293.3707886	0.18
294.1548462	0.07
295.3014221	1.81
297.1841431	0.17
298.0527344	0.06
303.3500977	0.10
305.1025391	0.53
307.1749878	0.61
309.2096863	0.07
310.3340454	0.11
315.0073242	0.41
317.5028687	0.03
323.1477661	6.12
324.1981812	0.43
325.2778625	1.43
327.0644531	0.67
328.0153198	0.18
333.3231506	0.15
335.1648560	0.22
338.6152039	0.07
340.2504883	0.11
344.6457520	0.03
345.3176270	0.08
351.1328125	6.42
351.8434753	0.03
359.5480652	0.07
360.3717346	0.04
369.3978577	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	324.2065
Annotation	Lysergic acid diethylamide
Peak:m/z	Relative Intensity
98.9160309	0.18
104.9381714	0.22
105.9708328	0.13
110.0089035	0.05
116.9766541	0.63
120.0569153	0.10
133.1826630	0.08
134.0977783	0.03
143.2552948	0.02
145.0679016	0.13
149.1338806	0.05
151.9396362	0.07
152.9978638	0.09
155.0614014	0.08
157.0637970	0.14
162.9435577	3.41
167.0971680	0.04
173.8729858	0.08
176.0617981	0.03
176.8801727	0.03
179.0607452	0.08
180.0321808	0.15
184.0641174	0.50
194.2369080	0.19
194.9417419	0.20
206.0478210	0.03
207.1229248	0.13
212.1311646	2.83
216.0339050	0.12
218.1226807	0.11
219.0138855	0.24
220.4032288	0.09
221.1593933	0.03
224.2605591	0.21
229.5514526	0.06
233.0537415	0.05
234.3273621	0.07
236.1613464	0.56
239.2981567	0.03
240.1230164	0.32
242.9592285	0.07
243.6701660	0.03
246.1741638	0.05
251.0736084	1.78
251.7148132	0.79
253.5840759	0.18
254.6940613	0.22
258.2039185	0.02
260.0505066	0.10
262.6502075	0.44
263.3559265	0.06
264.0895996	0.03
265.3376160	0.23
266.1303711	0.17
268.1063232	100.00
269.2315979	0.64
274.0158081	0.14
276.3082275	0.12
277.1597595	0.06
278.1046753	1.19
279.2457275	0.49
280.3308105	0.18
281.1241150	0.32
281.9574280	0.06
283.1512146	0.06
287.8404846	0.08
292.2606506	0.08
293.1402588	0.14
294.7373962	0.17
296.2043457	0.02
302.2874756	0.21
305.9809570	2.63
307.0684204	1.60
308.0989685	0.19
309.2786865	0.17
314.9735107	1.06
322.4970398	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	321.0583
Annotation	L-gamma-Glutamyl-S-allylthio-L-cysteine
Peak:m/z	Relative Intensity
104.8661804	1.11
119.0916672	0.11
120.0329742	4.03
126.1301270	0.03
127.9271698	95.91
130.8388977	0.11
151.0763245	0.09
152.9999390	1.12
153.7545929	0.22
157.8522797	0.16
159.0035400	0.18
169.0135040	7.34
171.0752563	34.52
179.1606445	0.21
184.9448242	2.36
191.9755859	0.91
197.0651550	1.34
203.0347443	14.08
213.1768494	0.12
215.0743713	38.59
229.1524658	0.58
231.1090393	6.04
235.3103943	0.06
247.0603027	0.38
249.0662842	100.00
267.1405029	0.07
272.0336914	0.09
273.2068481	0.06
274.0794678	0.12
275.3386841	1.07
277.3059387	0.28
280.1497192	0.25
284.2278137	0.05
285.2152100	0.22
303.0042419	14.77
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	667.2993
Annotation	5'-Hydroxythalifaboramine
Peak:m/z	Relative Intensity
285.0156250	0.09
343.1958618	0.27
393.3031006	0.06
401.2870483	0.28
409.4635620	0.05
412.0914917	0.04
414.3679810	0.30
438.1773682	0.18
451.0922241	0.06
459.0606079	0.28
461.5262451	0.24
477.7805786	0.09
479.1104126	0.17
487.2806396	0.11
530.1990356	0.24
534.0142212	0.06
559.2328491	0.18
563.2005615	0.03
575.9644775	0.09
578.1777954	0.13
581.4720459	0.22
589.3776245	0.05
608.6994629	0.26
609.4129028	0.15
621.4090576	22.03
622.3645630	0.44
623.3804932	0.21
625.1424561	0.47
626.3750000	0.07
631.4285278	0.45
644.2687378	87.83
645.6287842	1.06
646.6621704	2.28
647.6720581	0.31
648.4395142	0.22
650.0020752	1.22
650.9800415	0.11
652.5089722	0.33
653.3298950	0.28
655.0864868	0.08
690.9929810	0.10
739.6376953	0.10
757.5889282	1.87
851.5388794	0.17
853.4771118	0.11
903.7946167	0.58
919.6267700	2.34
1081.5290530	6.40
1082.6680910	0.10
1243.4981690	100.00
1244.6380620	0.71
1288.0986330	0.15
1289.1623540	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	581.1926
Annotation	N-gamma-Glutamyl-S-allylcysteine
Peak:m/z	Relative Intensity
162.0773315	0.03
170.0389557	0.85
172.0021820	0.05
175.3361969	0.09
181.9680023	0.02
187.9872131	0.20
205.1501160	0.02
212.2791290	0.03
228.0089722	0.09
234.0570679	0.08
272.9578247	0.53
274.1295776	0.60
281.6080322	0.10
291.0864868	100.00
291.6867676	0.36
331.7912598	0.06
360.1339111	0.05
375.4185181	0.08
377.2245483	0.05
398.1017456	0.10
451.5438843	0.09
536.6030884	0.25
537.3397827	0.12
538.2715454	0.02
562.3205566	0.14
563.4632568	0.20
564.4995117	0.11
583.3167114	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	357.25
Annotation	13,14-dihydro-15-keto Prostaglandin E1-d4
Peak:m/z	Relative Intensity
166.9685822	0.62
171.1281433	1.79
173.2092743	0.13
176.1482849	0.43
185.1438751	1.01
187.0958557	1.25
198.9891968	0.24
201.240387	1.70
203.257019	0.21
209.9486389	0.60
211.1043549	0.34
215.1115723	3.39
227.4137268	0.37
228.1993713	0.21
229.2370911	2.56
231.1346436	0.75
240.9315186	0.48
243.1701965	3.74
245.2809753	0.73
254.2459412	0.20
255.4370422	0.35
257.1481323	1.70
259.0184326	1.33
261.9016418	0.72
263.2389221	0.30
267.1670227	0.16
269.2249146	1.18
271.1722717	4.51
273.3829346	0.62
281.2954712	0.12
283.3546753	1.82
285.4797974	0.96
287.4417725	2.64
293.268158	0.23
295.4027405	0.27
297.25354	2.01
299.2681885	1.44
301.2949219	0.90
305.4071045	0.31
308.0882568	0.17
309.2610168	0.16
311.3872375	1.53
312.2149048	0.13
313.3299561	3.49
315.5343628	1.95
318.9432983	0.50
321.0939941	0.60
323.285675	15.47
325.3261108	1.39
330.2459412	1.17
339.2505188	100.00
339.8660889	0.60
341.3962708	14.79
342.3129578	0.58
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	300.02
Annotation	Unknow
Peak:m/z	Relative Intensity
85.0147934	0.24
87.9063644	1.41
95.1014328	0.06
100.9639664	0.43
104.8597107	0.84
112.9919739	1.45
113.8200302	0.13
116.0370178	0.30
118.9158478	0.35
121.9165039	6.18
124.1294861	0.09
126.6077728	0.18
130.8727264	0.08
132.9862366	0.89
134.2940369	0.07
135.6798401	0.13
137.8721008	0.12
138.8894958	2.67
143.1777954	0.35
144.9563599	6.64
147.1081238	0.26
148.1483765	0.41
148.9802856	0.76
151.9765015	0.28
153.1416626	0.30
158.0617371	0.35
160.0595398	0.62
162.0444641	62.98
165.8075867	0.22
168.7881470	0.09
170.9301147	1.29
172.7932434	0.12
175.2483826	0.14
178.9694366	8.54
185.9398346	0.38
186.9786072	0.09
189.1550903	0.30
192.0213776	0.51
193.9943390	4.20
200.9539795	0.17
202.1969910	0.13
206.7397156	0.09
209.1013184	3.20
210.4772949	1.70
211.1003723	1.06
212.1386108	0.31
214.8226318	0.51
216.1828003	0.32
217.1691284	0.20
219.7655334	0.15
224.1792908	0.34
226.0032959	100.00
229.2662659	0.14
236.0888977	1.75
237.3235779	0.43
239.2622070	0.28
240.4455872	0.35
241.1118774	0.43
242.3270569	0.17
243.6652222	0.50
246.7055359	0.83
249.9971008	0.25
251.1468506	0.47
251.8627930	0.20
253.0535889	0.73
254.3683472	0.22
255.5236816	0.74
256.3651428	0.54
257.3704834	0.24
258.0190430	0.52
259.1937561	0.29
260.6296082	0.72
263.8731384	1.66
264.7661133	0.25
265.5502930	0.08
266.3221436	0.08
269.2394714	2.03
271.3879700	0.64
272.1551819	0.14
276.8624878	0.62
281.1918945	3.10
282.2049561	8.11
283.2654419	6.72
284.2039795	0.60
290.9510803	0.48
299.0975647	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	425.19
Annotation	Marchantin C
Peak:m/z	Relative Intensity
126.0174713	2.59
133.9999390	0.07
136.1051788	0.03
140.7636719	0.03
142.8728333	0.09
151.0047150	0.16
152.1263733	0.19
153.2578125	0.04
157.1871643	0.18
162.0023499	0.20
164.1330566	0.06
175.2245178	0.10
176.0108643	0.32
181.4368286	0.16
182.8981018	0.10
188.4972534	0.12
192.3719330	0.27
204.9587250	0.05
205.9967957	0.08
208.4332123	0.07
210.1072388	0.14
215.4016113	0.25
217.3364868	0.12
218.0478973	0.12
220.0887451	2.27
222.2242126	0.14
227.1795959	0.11
228.1443481	0.54
229.0153503	0.06
231.0097198	0.17
232.9577332	0.05
235.0825500	0.08
237.2063599	0.08
241.3174133	0.17
247.3563538	0.14
249.3229675	0.15
250.9455261	0.14
252.4647217	0.05
253.2092896	0.14
257.3718872	0.11
260.2091980	0.56
261.9642334	0.24
262.9082031	0.40
264.2194519	3.62
273.4119263	0.25
274.8844604	0.91
275.6510010	0.35
276.3287354	0.32
279.2152710	0.10
280.1507568	0.10
281.4709167	0.08
285.2113647	0.12
291.0549316	0.12
292.3945923	0.05
293.1592102	0.58
295.0303345	0.16
296.4439087	0.26
302.2055054	0.03
303.2307434	0.12
304.0354004	0.12
305.2528381	0.30
307.3576050	0.56
309.3199463	0.11
310.9301758	0.11
312.2814331	0.18
316.3073425	0.24
317.0551147	0.63
319.2874756	64.65
320.2256470	7.23
323.1053772	0.05
324.7236633	0.06
331.3501282	0.20
335.1774902	0.59
336.0038452	0.03
337.3785095	0.11
339.1829529	0.33
343.4710693	0.37
345.5288696	0.14
349.0638123	0.10
351.3222961	21.32
353.1174927	0.86
358.1352539	0.74
359.2257996	0.87
360.3166809	0.37
361.3585815	0.05
363.3141785	0.77
364.0997009	0.06
365.4220886	0.06
369.2392273	5.07
376.3389282	0.04
378.5316467	0.12
379.4325867	0.19
381.1898804	100.00
382.2127380	0.11
384.0869446	1.06
396.5749512	0.10
397.1843872	0.18
405.1890564	0.04
406.1780701	0.27
407.3428650	1.50
416.0594788	0.45
425.4373474	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	263.0706
Annotation	N-Acetylcystathionine
Peak:m/z	Relative Intensity
85.8964005	0.02
122.1289520	0.07
127.9598846	100.00
128.8740540	0.04
134.0198364	2.09
153.0232391	2.04
171.1052551	1.62
178.9767914	0.20
197.1430054	1.51
201.1996155	0.03
205.1009064	0.07
215.1278076	6.77
227.1192322	4.05
245.1049957	38.95
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	272.0888
Annotation	Unknow
Peak:m/z	Relative Intensity
82.0145264	0.04
86.0282745	0.60
97.0618896	0.05
98.9914551	0.91
125.0704193	0.08
127.9496155	17.42
136.9797211	0.17
143.0687256	26.70
143.9782410	0.07
145.1167145	1.23
146.0227203	3.69
151.7845459	0.06
153.1163788	0.06
159.6308746	0.06
165.9838715	0.82
167.1339874	0.25
171.1500092	0.20
179.0774536	25.51
181.3968811	0.05
182.9461823	0.05
184.1544647	0.09
185.0933838	2.59
185.9846802	0.18
191.9558411	0.22
197.1593781	1.88
210.1670837	14.23
211.1046906	0.30
225.2371521	0.10
227.1007233	0.06
228.1262817	1.86
236.0235748	0.53
254.0597992	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	451.1843
Annotation	Unknow
Peak:m/z	Relative Intensity
197.2315369	0.03
244.2889099	0.07
253.0708923	0.11
255.4602051	0.02
277.1928711	0.13
280.7405090	0.16
284.9789429	0.03
287.1450195	0.08
291.3277588	0.04
297.5947571	0.10
299.3624268	0.67
303.0413818	0.11
307.0323181	0.09
315.1633911	0.19
316.0613403	0.22
318.4586792	0.01
319.2471008	0.05
333.2429199	12.12
335.1278992	0.14
337.5142212	0.07
343.1372375	0.14
345.2123413	1.40
346.1493530	0.55
347.2149963	0.18
348.9042969	0.03
353.4214783	0.16
355.0756226	0.17
359.2039795	0.82
360.7450562	0.13
363.4373169	0.03
373.3731079	0.06
377.1669312	100.00
379.2054138	7.42
387.2485046	0.09
395.1936646	0.06
405.1578064	0.21
407.4443665	0.12
410.0258484	0.12
411.6283264	0.07
413.3519592	0.07
414.4420471	0.10
415.3952332	0.08
417.4656677	0.11
421.1991882	0.13
422.4734192	0.09
423.3679810	0.13
431.0856018	0.03
433.2250061	0.23
441.4988708	0.04
451.1855774	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	690.2046
Annotation	Unknow
Peak:m/z	Relative Intensity
193.9260101	0.26
197.1436920	0.19
216.9870453	0.49
218.8625031	0.69
220.0460510	0.09
222.1020660	0.48
226.1208801	0.50
229.8245239	0.91
232.8717957	0.09
245.0709686	0.44
247.0673981	2.31
250.3897247	0.28
255.0290375	0.36
256.1696167	0.10
259.5822144	0.49
262.3105469	0.30
264.0736389	0.18
268.4329224	1.21
276.8333130	0.30
281.1439819	0.17
286.1404114	0.31
287.4171753	0.84
288.0991516	0.11
289.1054382	0.33
290.1701965	1.41
291.1681519	0.24
291.9974670	0.59
303.1298828	0.16
304.2605286	1.50
305.2357788	0.25
309.1527100	0.13
310.7738647	0.49
316.1414795	0.45
321.3313904	0.59
322.1744080	3.96
323.3642883	0.58
326.3997192	0.19
334.1545410	0.61
335.1288452	0.11
337.4695435	0.21
343.6854553	0.31
348.1741943	7.04
349.0191650	0.89
356.2242432	0.70
359.5820312	2.82
360.1905518	0.32
361.6155396	1.79
363.6307983	2.21
364.5758057	0.31
366.6326294	0.50
370.0987549	0.23
371.2020874	0.72
374.5468140	1.08
375.4753418	0.23
377.2374878	0.66
379.1338501	0.22
382.5627441	0.80
383.2662354	0.39
388.5404053	0.99
389.8645630	1.29
391.3489380	0.10
392.1063232	0.52
394.0088501	0.63
396.4987183	2.27
397.5531616	1.55
399.2966309	0.40
402.5396118	0.32
403.2431641	0.56
405.1454468	4.26
405.9722900	0.76
410.2833862	0.67
411.3125610	0.42
415.2512817	0.74
416.3936768	0.67
417.8999023	0.96
419.8670044	0.20
421.3067627	0.21
423.0874634	5.81
424.3311768	0.14
425.3678589	1.43
426.1517334	0.69
427.3535156	0.68
428.3194580	0.27
428.9541626	0.49
430.3997803	1.50
431.8161011	0.84
433.3592529	0.39
434.2711182	1.80
435.1804199	1.39
439.2403564	2.11
440.4188843	2.16
441.1605225	1.44
442.3959961	1.18
443.8037720	1.15
445.0234375	0.76
447.0017090	2.11
449.0676880	2.03
450.2713623	1.28
451.4152832	0.32
452.4807739	0.47
453.5372314	1.34
455.0286255	1.49
455.7487793	0.23
460.0800781	1.02
461.3930664	1.05
463.3993530	0.90
464.5377197	0.10
465.2258911	0.29
467.1986694	0.60
468.5153198	0.18
470.0422974	0.91
472.0777588	0.94
473.2048950	0.80
474.3453369	0.66
475.5394897	2.59
476.2197266	2.41
476.9528198	0.23
478.0838013	2.37
479.3632812	0.31
481.0366821	5.01
482.0563965	1.23
483.2456665	4.04
484.2005615	0.46
485.5426025	0.56
489.1648560	1.78
489.9365845	2.79
490.7064209	0.18
492.1363525	8.09
492.8130493	5.91
493.6356812	6.22
494.2561035	0.75
496.6820068	1.32
497.6653442	1.18
502.8664551	0.35
503.4768066	0.13
505.0098877	0.38
506.0330200	2.11
507.3494263	0.65
512.0847168	0.96
513.1583862	1.59
516.7749023	0.22
517.3762207	0.60
518.1713867	0.39
520.1997070	3.25
521.3636475	1.16
525.1493530	2.33
525.8224487	0.98
527.3542480	0.67
528.7759399	5.42
529.4655762	1.34
530.6213379	1.35
532.2661743	1.66
533.9426880	13.77
534.6685181	5.51
535.3194580	0.55
536.2561646	1.76
538.6126099	0.44
540.9666138	1.03
542.9279175	14.95
544.0676880	6.10
544.9138184	1.44
546.2530518	0.97
549.3202515	6.66
550.3927612	2.22
551.1511841	1.17
552.2772217	0.35
553.2680054	0.66
555.6080933	0.89
556.2614746	0.82
558.0220337	2.89
559.4783325	0.33
561.5769653	1.27
562.3166504	0.38
564.2243042	3.83
566.0432129	1.15
567.9873047	0.27
568.9767456	4.91
570.0020142	1.34
571.2199097	1.53
571.9703979	1.02
572.8302612	0.28
573.7986450	0.45
575.3868408	0.85
577.1926880	1.81
579.1542969	4.50
580.3717041	4.22
581.3609009	7.24
582.4291992	1.99
583.3463745	2.32
584.4060059	0.21
585.4196777	1.46
586.5432739	0.14
588.1128540	0.50
589.2409668	3.24
590.3716431	1.12
591.2555542	1.64
592.1809692	1.48
593.1748047	0.93
593.7882690	0.28
594.4524536	1.76
595.1168823	0.34
598.2495117	2.37
599.2950439	1.30
600.5397339	2.72
601.8370972	0.71
603.3163452	1.85
606.3069458	2.06
607.9674683	4.10
609.2875366	3.96
610.5856323	2.12
611.4137573	2.46
612.4857788	3.02
613.5261841	2.06
614.5529785	1.25
616.0925903	1.30
616.9951172	3.97
617.8894653	0.79
618.6015015	0.18
620.3140869	2.46
621.4395752	12.83
622.3725586	6.94
623.3001709	3.65
624.6278076	0.40
625.4700317	3.89
626.2299194	2.77
627.0421143	2.64
630.4127808	15.19
631.4430542	7.48
632.3108521	1.69
633.0993042	1.42
634.7168579	1.50
636.1621704	2.58
637.2150269	0.85
638.1560669	0.30
638.9580688	1.34
641.4573975	9.94
642.2607422	4.60
643.0308228	3.72
643.9072876	6.38
645.2495728	0.87
646.5072632	1.84
647.2740479	1.64
648.8344116	100.00
649.4635620	59.55
650.1532593	5.37
650.9790649	2.46
652.2179565	3.56
653.2385864	1.71
654.2183228	3.89
654.9602661	4.68
655.6950684	0.36
657.1596680	0.38
658.4223633	2.60
659.6920776	5.87
660.5645142	4.00
661.9402466	1.09
662.9083252	2.49
663.7180176	0.48
665.1206665	7.50
665.9354858	3.90
666.7577515	2.93
667.4568481	0.99
669.7144165	5.83
670.6682129	4.62
671.5885620	2.42
672.6865234	1.21
673.5125122	6.00
674.2260132	0.34
675.5023193	4.90
676.3163452	0.13
677.1419067	1.27
678.7276001	69.23
679.7919312	13.16
680.8615112	1.87
681.8673096	1.55
687.4347534	0.26
692.9129639	0.17
695.3336792	4.53
696.2175903	1.85
697.3579712	2.19
698.4240112	0.94
700.4383545	0.69
701.0922852	0.15
702.1113892	0.25
703.4556885	0.31
706.5051880	0.74
708.3081055	0.28
710.0958862	1.38
711.3679199	1.48
713.2443237	0.09
714.7307739	0.93
716.2440796	0.29
719.0524292	0.38
720.4938965	0.29
722.0921631	0.82
722.9782104	0.31
723.6802368	0.24
726.3182983	0.46
727.4343872	1.21
728.2706299	0.68
730.6541138	0.75
731.5422974	2.27
732.5923462	0.47
733.4830933	0.23
737.0103149	1.92
738.1217651	0.58
741.5595093	0.56
743.5648804	0.30
746.2447510	0.27
748.4665527	0.62
749.2040405	1.60
757.3944702	0.75
760.0653687	4.41
760.9608765	0.46
763.2149658	1.34
764.4713745	2.32
765.4352417	0.53
766.3087769	0.48
769.1731567	1.00
770.3897705	0.32
775.4257812	0.55
777.7163696	0.25
780.1028442	0.33
781.1682739	0.17
783.8379517	0.71
786.1597900	0.28
787.2699585	0.37
788.5195923	0.37
790.2730103	0.81
791.2197876	2.98
792.6918335	1.29
793.6222534	0.44
796.2997437	0.15
800.4649048	0.28
802.0467529	0.14
803.7704468	0.53
808.1974487	5.83
809.3239136	26.25
810.3317871	15.92
811.2311401	5.30
812.4003906	2.83
813.5643921	1.64
814.5115356	1.30
815.7150269	0.49
816.6088257	0.59
819.0092163	0.29
820.4674683	0.61
821.3689575	0.97
822.0875854	0.11
823.3304443	0.74
824.2819824	1.89
825.4038086	0.47
827.4361572	0.15
831.7138672	1.02
833.2862549	0.15
837.2448730	1.33
838.3298950	4.79
840.3927002	1.32
841.8616333	0.64
845.1390381	0.34
847.3226929	6.43
848.1489868	1.81
848.8981934	2.53
850.0969849	0.25
851.2962036	0.15
855.1218872	2.12
856.3139648	2.18
857.1898804	0.35
858.2756348	0.77
859.4844971	0.33
863.8862915	1.09
865.0698242	1.72
866.1997070	2.33
867.2081909	0.48
868.2276001	0.63
869.3416138	0.85
870.1193848	0.42
871.2973633	0.27
874.1087036	5.30
874.8980103	5.45
875.7506714	1.10
876.3688965	0.13
877.3325195	0.33
880.0726929	0.38
883.5348511	0.35
884.9169922	0.30
886.4080200	0.46
887.4426270	0.57
889.3983765	1.56
890.8022461	0.34
891.7048340	0.34
892.3798218	0.27
893.1837769	0.94
894.2004395	0.72
895.3044434	1.18
900.8837280	1.27
902.7637329	1.12
903.5564575	2.75
904.3149414	3.45
905.2680664	0.32
905.9592896	0.20
907.6647949	0.35
908.8668823	0.24
909.5671387	1.95
911.5385132	24.86
912.3554688	9.30
913.0396118	6.33
915.9917603	1.14
920.5937500	0.21
921.2783813	1.07
922.4828491	2.25
923.3156128	0.27
924.2545776	1.18
925.9292603	0.48
926.7506714	0.80
928.0449829	0.75
930.3775024	0.66
931.4707642	0.44
938.4811401	6.30
939.2465210	2.34
940.2655640	1.35
940.9431763	0.13
942.2080688	0.45
943.6336060	0.15
945.0322266	2.30
947.1981812	0.38
948.5182495	1.62
950.2473145	0.12
953.1370239	4.27
954.4685669	0.79
956.3871460	1.43
957.6550903	0.52
958.5461426	0.79
959.2514648	0.69
961.5422363	3.76
962.2218628	1.98
962.9463501	2.02
963.6398315	0.75
965.4428711	0.55
966.5175781	1.63
967.5127563	2.32
968.4279785	1.78
969.5468140	0.76
970.4653931	3.06
973.5027466	0.41
976.8984375	0.12
977.5063477	0.12
978.4802246	1.05
979.4714966	0.49
981.2532349	0.26
982.1398315	0.66
983.6391602	15.02
984.3668823	49.55
985.4097290	26.59
986.3450317	20.77
987.3456421	4.06
988.4111938	0.32
994.3460083	0.13
995.5265503	2.00
996.3303223	0.41
999.2180786	7.74
1000.1306760	4.17
1000.9425660	0.50
1002.6237180	1.18
1004.1770630	0.25
1006.4125370	0.33
1007.7299190	0.30
1015.3858030	0.20
1016.3472290	0.34
1017.2169800	0.16
1019.3928830	0.13
1027.2340090	0.48
1028.1757810	0.50
1032.5725100	0.52
1036.7596440	0.10
1038.3879390	0.31
1039.9310300	1.05
1041.4973140	0.18
1046.5904540	0.44
1051.1308590	0.45
1053.0205080	1.79
1056.4433590	0.34
1058.3143310	0.19
1066.2474370	1.37
1067.3198240	4.12
1068.3076170	3.04
1069.1486820	0.76
1070.2353520	0.97
1078.1218260	0.28
1084.2478030	6.40
1085.3088380	16.02
1086.4063720	9.75
1087.3907470	5.21
1088.4273680	3.31
1089.0704350	0.67
1095.6943360	1.10
1096.3137210	0.21
1098.4646000	0.82
1099.4333500	0.42
1101.5737300	0.44
1111.5957030	0.30
1112.9476320	0.81
1113.8961180	1.59
1115.1912840	1.43
1116.3125000	1.07
1117.5327150	0.23
1127.5350340	1.49
1128.2088620	0.28
1129.4544680	0.20
1130.3417970	0.64
1131.1999510	2.33
1133.2355960	0.96
1148.3024900	0.44
1170.9973140	0.24
1181.6225590	0.44
1184.4201660	0.32
1185.4930420	0.18
1194.5625000	0.12
1198.6085210	0.39
1201.2640380	0.62
1202.0468750	0.30
1211.4666750	0.47
1213.6397710	0.36
1216.2751460	0.86
1217.7705080	0.63
1223.4333500	0.30
1226.5095210	0.66
1227.4547120	0.87
1228.4068600	2.73
1229.1234130	0.75
1231.0662840	0.08
1231.7458500	0.13
1242.3879390	1.22
1243.1108400	1.01
1245.2879640	1.02
1247.4406740	1.07
1248.3782960	0.38
1259.0814210	0.89
1260.0421140	1.52
1260.7789310	1.89
1261.5562740	1.63
1262.5115970	1.10
1297.2034910	0.34
1326.0155030	0.34
1339.5267330	0.77
1341.3320310	0.35
1356.3199460	0.23
1357.3297120	0.64
1359.3593750	0.26
1373.2762450	1.19
1374.4272460	1.17
1375.0455320	0.50
1417.3341060	0.17
1427.7871090	0.08
1530.5314940	0.27
1587.3946530	0.41
1695.5843510	0.30
1720.0797120	0.22
1779.2779540	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	259.1299
Annotation	Leucyl-Glutamate
Peak:m/z	Relative Intensity
81.7565765	0.04
127.9214478	100.00
130.0477295	3.60
153.2178955	0.04
197.2040405	0.04
201.1354523	0.04
202.0092468	0.02
223.1206818	8.74
231.2670135	0.08
241.2147064	35.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	763.1911
Annotation	Pelargonidin 3-(6''-p-coumarylglucoside)-5-(6'''-acetylglucoside)
Peak:m/z	Relative Intensity
221.0733185	0.07
250.2059021	0.03
250.8634338	0.05
259.0065918	0.35
323.1517029	0.19
341.1080627	1.00
383.2943726	1.27
395.1415405	0.12
421.3493042	0.50
425.3157959	0.02
439.1978149	0.58
443.0136719	0.44
467.4982300	0.12
485.1435547	2.25
493.4467163	0.04
503.1814575	0.88
544.9132690	0.09
565.0903931	0.12
575.2762451	0.07
583.1354370	0.69
601.1934204	2.22
665.2518311	100.00
745.2708130	12.50
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	564.3305
Annotation	Unknow
Peak:m/z	Relative Intensity
219.0147858	0.01
220.0928497	0.01
258.6707153	0.01
266.1607971	0.03
279.3686829	0.52
299.3828125	0.01
307.2449341	0.03
337.4956055	0.01
365.1408691	0.02
381.5825806	0.05
391.4294434	0.09
392.5365601	0.01
400.2033081	0.04
415.3220825	0.05
417.4190063	0.01
418.4346313	0.05
424.4484253	0.02
425.4825439	0.02
430.4694214	0.04
433.2656860	0.03
437.6744385	0.01
451.5164795	0.03
477.6743164	0.02
479.6649170	0.01
484.7709961	0.05
487.5451050	0.08
504.3567505	100.00
505.3984985	0.19
517.1878662	0.08
518.2439575	0.02
520.3898315	0.03
528.2858887	0.07
529.1276245	0.02
532.3557739	0.06
545.1712646	0.02
546.8395386	0.02
547.5316162	0.06
563.9168091	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	568.2391
Annotation	Unknow
Peak:m/z	Relative Intensity
166.0745239	0.28
168.0659637	0.23
182.1486359	0.14
183.1605988	0.64
186.1314087	0.41
195.3101349	0.14
196.1812744	0.16
211.0865173	0.16
213.2030640	0.28
225.0828094	1.30
226.2853699	0.41
233.1143494	0.16
241.1010132	0.68
243.1747284	6.55
244.1118469	1.42
258.2749634	3.30
263.2980957	1.35
269.1960144	0.16
281.2008057	3.66
282.1892090	0.32
286.0467834	17.97
286.9803467	0.77
308.1475220	0.23
317.8666382	0.11
319.2624512	0.24
320.2061768	0.14
326.2861328	0.14
329.3807983	0.40
335.3457642	0.96
336.2443848	6.41
345.9627075	0.17
354.2187500	0.16
359.1907959	0.28
361.4272461	0.40
373.3117676	0.36
374.1489868	0.13
381.3027344	0.47
388.4569702	0.86
391.0662231	0.26
399.3233643	0.28
402.3714600	1.14
403.2760620	0.21
404.9762573	4.59
406.2131348	2.71
406.8428345	0.07
409.8664551	0.88
417.2831421	0.22
419.1594849	100.00
419.8455811	0.20
422.0593872	0.63
435.3061523	9.81
438.0821533	0.59
463.3679199	0.45
465.3666992	0.14
472.0619507	0.55
478.0816040	0.09
479.1716309	0.45
498.6228638	0.39
502.2830200	0.53
504.9334106	0.19
509.4050903	0.34
511.3703003	0.55
521.2346802	0.79
522.3921509	0.21
525.4998169	0.19
530.5360718	0.10
531.4778442	0.19
533.2450562	0.32
535.5693359	0.58
538.3141479	0.42
549.4924927	1.77
550.3858032	3.17
551.2423706	0.80
560.0963135	0.06
561.8087769	0.45
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	478.1577
Annotation	(+)-duocarmycin SA
Peak:m/z	Relative Intensity
134.1475983	1.06
135.9346008	100.00
144.9945374	4.31
152.0100250	0.35
153.1687317	0.70
154.1932068	0.35
162.3322754	0.96
162.9830475	8.20
179.0831451	1.71
180.1995697	0.46
247.0331573	2.27
252.7744751	0.50
259.0133667	3.80
271.0350952	1.52
276.4125366	5.83
277.1028137	0.35
283.3506165	0.37
287.0658264	0.35
288.2269592	1.68
288.9632874	18.75
297.8927612	81.79
298.5932007	0.82
300.9019470	2.26
306.8084106	12.15
307.4287720	0.47
315.0927124	10.04
315.8319397	83.66
323.9460754	5.45
324.9428101	41.68
332.2711792	8.95
342.9421997	6.01
344.7299500	3.12
345.5034180	0.96
347.3975830	0.79
349.3377686	0.45
376.3906860	0.57
377.4931335	1.48
381.5281677	0.35
403.2068481	0.24
437.2948303	0.53
441.7836609	0.50
460.1375122	7.94
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	352.07
Annotation	Unknow
Peak:m/z	Relative Intensity
128.7723389	0.08
143.0584412	0.07
161.4849243	0.05
162.8014679	0.08
167.7706909	0.09
172.1984253	0.09
175.1133575	0.02
175.8733978	0.02
178.1029663	0.31
190.3670807	0.91
206.3664246	0.08
216.2171326	0.03
225.5478210	0.11
244.0769653	13.75
257.2590942	0.05
262.0747986	100.00
264.0029907	0.17
271.9909363	0.05
279.9937134	0.03
282.4333496	0.18
288.3172302	0.05
289.1745605	0.08
292.1333008	0.13
292.8782654	0.02
294.0526733	0.37
295.6137695	0.03
297.3317871	0.07
304.0875854	0.04
305.2335510	0.05
305.9908447	0.29
307.2673950	0.08
310.1412659	0.26
310.8219604	0.10
316.1878052	0.31
317.1534424	0.43
320.2179260	0.04
328.7825317	0.18
333.9745789	8.03
334.5917969	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	394.13
Annotation	(gamma-Glutamyl-gamma-glutamyl)-S-methylcysteine
Peak:m/z	Relative Intensity
115.1624146	0.01
129.9814453	0.19
143.8978577	0.52
149.1729431	0.02
161.9914246	2.50
172.0519714	0.49
189.0205383	0.03
190.0019989	0.01
201.0737915	0.02
204.0671082	0.03
209.2508545	0.02
210.9908142	0.05
216.9899597	0.07
230.0365295	4.83
247.2572937	3.10
248.0788574	9.66
262.9312134	0.09
265.0550842	100.00
265.6748047	0.11
273.2195435	0.05
278.1886597	0.02
288.2756958	0.03
289.2522583	0.06
290.5208130	0.29
291.2209473	0.01
297.2951965	0.02
301.0416260	0.18
301.9489136	0.03
303.4008789	0.10
304.1445923	0.15
317.2133484	0.06
319.1205750	3.98
319.7257080	0.04
331.1533203	0.25
332.1231079	0.07
334.1610107	0.05
334.8843079	0.01
340.3435059	0.04
346.2559509	0.03
348.3664246	0.04
352.0703735	0.01
358.0527039	0.10
376.1343384	3.02
377.3118591	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1249.3494
Annotation	Unknow
Peak:m/z	Relative Intensity
383.3414917	0.04
544.9575806	0.16
647.3830566	0.13
665.2784424	0.19
707.3360596	0.42
762.8837891	0.19
809.4141235	0.37
827.2028198	0.03
869.3149414	0.53
907.3665771	0.05
925.2554932	0.14
971.5250244	0.57
989.5021973	0.03
1031.6621090	0.06
1051.0474850	0.22
1069.2839360	0.09
1087.0894780	0.43
1088.0577390	0.05
1151.3658450	100.00
1152.0378420	0.45
1231.3529050	8.84
1232.0043950	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	314.118
Annotation	Unknow
Peak:m/z	Relative Intensity
93.8742218	0.14
95.2086334	0.04
95.9211502	0.08
96.7977142	0.07
101.1971588	0.04
109.2032318	0.42
110.9918976	1.21
113.0728073	2.48
125.2586899	0.07
127.9678421	46.08
139.1550293	0.06
145.1105652	0.19
151.0806885	0.25
152.9828491	0.06
153.9406738	0.08
158.8641510	0.03
163.4569702	0.03
178.1363525	0.32
179.1099854	1.29
181.0518799	0.03
196.0978088	7.75
197.0740967	0.14
210.1458740	0.25
211.2771912	0.02
216.2642822	0.05
222.1614380	30.53
223.2147827	0.06
225.2610779	0.08
238.5690002	0.34
240.1292419	100.00
252.1593323	0.39
254.1220703	1.08
257.2626343	0.04
264.9171448	0.05
267.3482056	0.05
270.1024170	2.53
271.2880859	0.14
280.3223572	0.16
284.0536499	0.17
286.2306519	0.05
296.0760498	7.51
297.3659058	0.11
299.1619873	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	781.2228
Annotation	Unknow
Peak:m/z	Relative Intensity
241.1247253	0.05
245.3295593	0.05
259.3986206	0.14
264.9289856	0.24
277.2210388	1.73
283.4208374	0.11
306.2010803	0.04
321.2717896	0.11
322.1537781	0.04
341.0399780	0.10
344.3849487	0.07
379.1168823	0.11
380.1942749	0.21
398.0972290	0.10
443.1843262	0.07
492.6619873	0.27
511.1126099	0.17
512.0411987	0.19
544.2156982	0.04
588.9970703	0.15
643.0222778	0.07
644.6184692	0.27
645.4841919	0.07
662.3202515	0.64
663.2639160	0.07
665.2850952	100.00
666.5965576	0.34
688.9947510	0.19
694.1848755	0.18
719.3237915	1.11
720.4398804	3.57
721.2257690	0.19
731.6777954	0.17
737.2227173	0.45
738.3905029	3.94
739.4398804	0.52
740.7317505	0.05
748.0040894	0.33
748.7298584	0.33
749.4575195	0.12
763.3129883	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	661.2461
Annotation	5'-O-beta-D-Glucosylpyridoxine
Peak:m/z	Relative Intensity
190.0425415	0.24
221.9585876	0.33
229.9710083	0.11
251.9975891	0.21
269.8067932	0.14
271.9632263	0.15
273.1966553	0.39
274.8987427	0.14
280.9655457	0.09
299.9796143	0.04
302.9772339	0.22
311.0452881	0.24
312.2236023	13.22
318.3161011	0.11
319.0408936	0.91
327.6014709	0.33
328.2323608	0.18
330.2327576	100.00
331.3055725	0.15
347.0908203	0.26
352.0953369	0.17
377.9306641	0.15
391.8410034	0.28
393.0668945	0.49
397.3667603	0.15
404.1389771	0.14
447.1307983	0.03
452.2658081	0.09
453.3354492	0.14
462.6720581	0.26
465.3163452	0.03
481.2513428	0.28
482.2523193	1.40
483.2080688	0.12
484.0499878	0.18
487.3340454	0.32
488.3485107	0.07
491.0816650	0.11
498.2727661	0.27
499.3991699	0.75
505.1911011	0.04
508.4252319	0.13
514.0078125	0.06
526.1764526	0.15
543.3660278	0.09
563.1329956	0.90
571.2064209	0.12
578.2835083	0.05
600.2153320	0.10
601.2704468	1.34
620.0039673	0.19
625.2143555	0.05
642.5759888	0.35
643.2514038	0.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	365.1816
Annotation	(1R*,2R*,4R*,8S*)-p-Menthane-1,2,8,9-tetrol 9-glucoside
Peak:m/z	Relative Intensity
110.6417389	0.09
111.2627411	0.08
113.0018921	2.49
117.3827515	0.04
118.9134064	0.70
122.9309921	0.14
124.9783173	0.17
127.0555267	0.46
128.8549805	0.07
130.8819580	0.41
137.1884155	0.09
139.1150970	0.20
141.1194611	0.16
143.0876923	0.85
149.0079041	0.20
151.9926758	0.20
155.0926819	0.51
157.0984039	4.32
159.0069885	0.16
161.1132812	0.40
163.3374634	0.07
169.0241089	0.13
171.2117920	1.12
178.9768677	1.12
181.0727539	0.16
183.3157349	0.04
185.1225433	2.04
186.0971375	0.18
187.1473236	1.87
199.1281891	5.53
201.1517029	0.37
203.1914520	100.00
207.1325378	0.44
217.3233337	0.07
218.6679382	0.18
221.0736694	0.06
225.4772034	0.05
227.1463623	0.23
233.3314819	0.08
239.2989502	0.21
240.2474365	0.04
243.0693970	0.07
245.1490784	8.23
247.1808167	0.34
248.9729309	0.14
257.2140808	1.58
258.9986572	0.54
263.2174988	0.27
264.1973267	0.30
275.1185303	0.45
276.1448059	0.05
277.3737183	0.33
278.2283630	0.36
291.1309814	0.15
302.3867188	0.95
303.2589722	0.73
304.3809509	0.24
305.0683899	0.15
308.2457886	0.06
319.2463379	1.23
320.2705688	1.55
321.3269653	1.39
322.3068237	0.66
323.5746460	0.04
329.2429199	0.03
340.9556274	0.06
344.6115112	0.48
345.2217407	0.33
346.2928772	1.84
347.2551270	1.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	452.0988
Annotation	Unknow
Peak:m/z	Relative Intensity
128.0409241	1.39
134.9384308	0.30
143.0692902	5.51
143.7866364	0.31
145.0572510	0.04
146.0272522	1.49
153.0995331	0.29
156.1182861	0.17
157.0193024	0.15
160.0843811	0.33
166.1067047	0.07
167.0535889	0.54
169.0191650	2.20
169.7671356	0.05
171.1044006	0.20
177.0657349	0.42
179.0576477	7.58
181.1549835	2.31
184.9701385	0.92
192.0853882	0.26
196.8494873	1.39
203.0595398	2.89
207.9478149	0.06
210.0646973	6.90
211.0406189	0.26
215.0357666	3.26
217.2719574	0.14
228.1068573	0.49
231.1080017	8.21
235.9387665	0.37
242.2014771	0.14
248.4637146	0.66
249.1554871	4.21
254.1554871	33.63
257.1174011	0.10
265.0110168	0.23
269.9622803	0.20
272.1338806	100.00
279.9713745	0.17
286.1844482	0.12
288.1776123	21.77
304.1340027	0.68
306.2039795	82.20
310.2069702	0.11
314.4224548	0.26
321.9090881	0.11
323.0316467	0.53
325.9645996	1.14
328.2018433	0.87
346.2351379	24.77
360.0731201	14.97
368.1672668	0.10
378.1642151	85.84
389.3950500	0.45
393.1001282	0.14
408.5280151	0.06
411.1239929	23.29
415.4041443	0.07
431.1729736	0.67
434.1448669	30.46
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	564.193
Annotation	Unknow
Peak:m/z	Relative Intensity
161.0422668	0.06
164.1567230	0.04
193.0566711	0.13
235.1046143	0.07
238.0762482	0.11
247.2318573	0.08
275.4406738	0.04
301.8675537	0.17
305.3851929	0.04
323.3743286	0.13
332.1252441	0.09
347.1749878	0.03
353.1906738	11.59
354.1369629	0.06
355.4879761	0.12
377.9861450	0.37
397.6003418	0.40
399.1705322	19.64
400.2950439	0.06
409.4439697	0.02
426.8004761	0.04
429.0596924	0.14
430.3669434	0.07
449.9624023	0.14
462.1832275	0.10
470.4342651	0.11
480.1437988	0.05
502.2296753	0.11
506.0715332	0.06
518.1171265	100.00
518.7598267	0.56
520.2932739	0.09
523.0504761	0.11
537.1371460	0.05
546.5117798	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	509.1782
Annotation	Unknow
Peak:m/z	Relative Intensity
152.0470276	7.37
161.0565491	0.06
164.2458496	0.11
164.9667358	0.05
213.0151367	2.77
214.4288330	0.08
252.4093323	0.22
254.0046692	100.00
261.3267212	0.03
302.2396240	0.11
311.0388794	0.13
312.2846069	0.12
314.0670166	0.08
343.2196045	0.13
375.4907837	0.13
380.0231934	0.07
406.1016235	0.07
406.9202271	0.15
429.5003662	0.11
466.0096436	0.17
467.7665405	0.24
491.0789795	0.52
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	670.185
Annotation	Unknow
Peak:m/z	Relative Intensity
193.1040955	0.11
199.0837708	0.25
202.1612549	0.15
212.8225098	0.10
220.0788879	1.88
224.2109680	0.07
227.9636230	0.21
231.3513947	0.07
234.3703918	0.06
237.0335388	2.26
239.5983582	0.09
248.0916748	0.21
255.9050598	0.19
266.8754272	0.22
273.0902405	0.23
287.1401978	2.08
287.9389648	0.22
290.0885620	0.14
291.3316650	1.49
292.4855957	0.54
299.6083069	0.04
303.1529846	0.13
305.1828003	2.05
310.3741455	0.08
311.4740601	0.18
320.3029785	0.10
322.1133423	0.56
325.1276245	0.15
328.4055786	1.17
342.2710571	0.18
346.2869873	0.25
346.8994751	0.06
348.3706665	0.07
356.2371826	0.72
360.2145996	0.18
364.1435547	0.06
366.2006226	4.00
374.2066040	3.66
375.4827271	0.05
384.5350342	0.11
385.8937378	0.11
387.9492798	0.10
389.3774414	0.06
392.2109375	0.68
394.5476074	0.20
399.6643677	0.11
401.2182617	0.24
406.2606201	0.25
409.3076782	0.35
410.3833008	0.86
411.2546997	1.00
416.1608276	0.37
420.1752930	0.20
421.8877563	0.12
424.1648560	0.22
425.0184326	0.24
426.3296509	0.22
431.3246460	0.13
432.2081909	0.13
434.0773926	0.08
438.2042236	1.02
443.2264404	0.14
448.0600586	0.66
449.1840820	2.28
450.1307373	0.06
457.1131592	0.20
458.2311401	0.05
459.2572021	0.16
461.9359741	0.19
466.2453003	13.20
467.2039795	1.68
469.4963379	0.06
471.1810303	0.66
472.4380493	0.14
481.3297119	0.14
482.6361084	0.32
485.0831299	1.57
490.2806396	0.05
493.5045166	0.21
494.6888428	0.18
499.5537720	0.34
500.2537842	0.10
503.2528687	1.90
504.9282227	0.22
508.3424072	0.41
521.2919312	2.09
523.0659790	1.02
531.5578003	0.18
532.4866943	0.11
535.6543579	0.09
538.2168579	0.94
539.4025879	1.43
541.2268677	100.00
545.9458008	0.09
550.0043335	0.26
553.5272827	0.06
554.1694946	0.21
555.4669189	0.05
560.4172363	0.45
564.4175415	0.11
567.2462158	0.24
577.2070923	1.22
578.3326416	0.23
580.0086060	0.74
589.6068726	0.16
591.2740479	0.14
591.9201660	0.21
593.1417847	0.33
595.1672974	11.05
596.2546387	0.43
598.3046265	0.06
607.2052002	0.53
625.4351196	0.06
626.7909546	0.11
629.2741699	2.82
633.7338257	0.27
646.2280884	0.18
646.9716187	0.25
651.2981567	2.34
652.3049927	5.71
653.3219604	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	374.1071
Annotation	DIMBOA-Glc
Peak:m/z	Relative Intensity
118.9598999	0.41
121.0124359	0.02
122.9381409	0.79
123.7024384	0.04
128.4997253	0.02
130.0802612	0.18
135.9528656	3.22
137.1513214	0.04
147.0637512	1.15
148.2687531	0.03
164.9627380	11.30
165.5889282	0.06
166.3059082	0.04
174.9874420	0.42
179.0379486	0.05
181.9855347	100.00
183.1386566	0.17
191.9566193	0.10
193.4280090	0.05
194.2661133	0.19
195.1332855	0.05
212.0822754	1.31
232.9788818	0.05
234.9432373	0.04
235.9261475	0.11
238.1459961	0.01
240.3189697	0.11
241.0764160	0.05
242.1058350	0.02
243.1412354	0.05
266.1192932	0.04
267.3038940	0.05
273.2653809	0.02
284.2864380	0.35
296.4091797	0.10
308.4635010	0.02
310.2734985	0.64
316.9538269	0.02
328.0516663	0.16
330.1880493	0.37
338.3365479	0.07
355.0633850	0.17
356.2353210	0.73
357.1037598	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	579.1795
Annotation	N-gamma-Glutamyl-S-allylcysteine
Peak:m/z	Relative Intensity
171.2330627	0.40
172.1914062	0.02
179.0577698	0.48
179.7855835	0.04
197.1473541	0.21
197.9135284	0.02
215.1976318	0.75
216.0537415	0.01
227.5779724	0.01
253.0970001	0.41
254.2883911	0.02
271.2337036	2.22
272.2716675	0.15
289.1339417	100.00
290.0977783	5.44
363.6508789	0.00
560.8522339	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	581.1512
Annotation	Polygalaxanthone V
Peak:m/z	Relative Intensity
179.1996918	0.09
191.1444397	0.06
200.4359894	0.13
202.1239014	0.09
235.1737823	0.05
251.2274933	0.08
272.3589478	0.16
281.1826782	3.14
285.0865479	0.05
306.2247925	0.10
313.2347412	0.06
323.2604370	0.27
325.3574219	0.04
357.4977417	0.11
360.1188965	0.16
362.0942383	0.08
364.3653564	0.07
371.2859497	0.07
377.5105591	0.02
402.2125854	0.07
403.9049683	0.02
415.5820923	0.04
419.1954956	100.00
437.2754517	0.35
443.2192383	0.25
444.2896729	0.04
445.2628174	0.20
454.4193115	0.03
459.4385986	0.22
461.2942505	1.84
463.1378784	0.09
470.3894653	0.08
472.3625488	0.15
473.2151489	0.04
480.4610596	0.03
484.2424927	0.16
488.0200806	0.17
489.3600464	0.22
490.3110352	0.33
491.3342285	0.07
492.4335327	0.25
493.2821655	0.35
494.2816772	0.05
496.2735596	0.20
497.3948975	0.05
503.1753540	0.06
504.5205688	0.12
506.3593750	0.11
517.0736084	0.09
518.1560669	0.15
519.2405396	0.15
521.1657104	0.09
522.4478149	0.80
523.4465942	0.26
524.6597290	0.24
534.6154785	0.83
535.4735718	0.29
536.4343262	0.49
537.5651245	0.70
538.3659058	0.33
539.2319336	0.42
540.1371460	0.30
557.6043091	0.20
559.8321533	0.58
562.4262085	0.49
563.1577759	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	625.1133
Annotation	Unknow
Peak:m/z	Relative Intensity
179.1486664	0.52
185.0262604	0.25
197.1171875	2.13
198.7459412	0.08
214.3389130	0.05
222.0500793	0.11
222.9610291	0.08
229.1190033	0.31
230.5454102	0.21
231.1658325	1.20
238.1500397	0.11
239.5939941	0.15
240.2692413	0.23
261.1099243	0.04
266.2457886	0.46
274.2908630	0.07
284.0656128	0.16
285.1217651	0.05
291.0165405	0.10
297.9579468	0.05
301.4688721	0.08
303.2301941	1.12
304.4193115	0.02
307.2852783	0.35
308.2829590	0.22
309.4441223	0.04
312.9232483	0.09
315.2709961	0.07
321.1221924	0.13
325.3253784	1.15
326.2125244	1.23
333.1648560	0.06
340.2164917	0.08
351.1857300	0.75
357.2599487	0.42
359.2153320	1.70
364.5403442	0.20
365.4028931	0.08
369.2248535	2.77
371.5405884	0.21
372.3614502	0.32
377.0080566	0.10
380.6202393	0.05
383.0543213	0.12
385.1072388	0.35
390.2197876	1.68
395.1433105	1.58
401.4722290	0.34
403.1262817	1.00
404.2031250	0.19
405.8128052	0.19
410.1758423	0.07
413.1998291	4.18
414.7227783	0.28
415.5023804	0.06
416.4015503	0.10
427.0170898	0.03
428.6966553	0.27
429.3333740	0.06
431.2066040	1.52
432.1549683	1.29
433.1452026	2.80
434.1252441	0.80
436.3695679	0.10
439.2152100	0.03
443.2153320	0.26
445.2107544	0.27
446.3204346	0.17
447.1752319	1.04
457.1147461	1.25
460.4110107	0.37
462.2807617	0.10
475.2055664	21.33
477.0939331	0.47
478.1599731	3.30
479.2156982	4.88
483.3367310	0.40
487.3331299	0.23
489.2944946	0.13
490.2637939	0.06
492.3792114	0.05
496.1142578	0.57
501.2713623	8.88
503.3220825	0.04
507.1546631	1.13
509.2771606	0.04
510.4295654	0.15
511.0863647	2.92
512.0540161	0.47
519.1624756	100.00
519.8554688	0.58
533.0183105	0.47
535.1694946	1.52
548.1851807	0.07
549.4664307	0.25
551.0422974	1.83
551.7041626	0.08
553.2263184	4.51
554.3613281	0.04
556.8971558	0.09
558.8435669	0.08
559.8417969	0.30
563.2941284	0.13
565.9916992	1.56
569.4802856	0.10
579.0753784	0.10
581.5408325	0.11
584.1098022	18.12
588.7122803	0.48
597.3842163	0.19
604.2661743	0.18
607.0594482	13.41
607.8527222	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	203.0826
Annotation	Ethotoin
Peak:m/z	Relative Intensity
72.0637207	0.15
73.9219360	0.64
116.0400848	33.44
128.0712891	0.71
129.0982208	0.29
130.0428772	0.70
131.9583130	0.26
142.0001678	14.40
144.2707520	0.04
157.0102997	0.26
159.0393066	100.00
169.2471161	0.07
173.0069427	2.52
185.0838623	1.01
185.9977875	9.77
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	504.3098
Annotation	PE(20:2(11Z,14Z)/0:0)
Peak:m/z	Relative Intensity
151.9556580	0.42
167.8658142	0.05
224.3625946	0.16
242.0494537	1.77
261.4690552	0.36
279.2802429	100.00
289.8414917	0.07
307.2489319	0.08
313.0840454	0.08
327.2247009	0.15
400.2424622	0.27
403.6500854	0.16
413.9611511	0.05
416.1961060	0.04
422.0276489	0.04
428.4929199	0.34
430.4550476	0.39
438.5515137	0.13
442.7283020	0.10
444.5816956	0.22
454.2395325	0.06
458.2607117	1.18
459.4212952	0.26
461.0422668	0.88
463.2801514	0.05
467.1775818	0.07
468.2203674	1.89
485.3432007	0.06
486.1689758	0.71
487.4512634	0.26
495.2469177	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	563.18
Annotation	Unknow
Peak:m/z	Relative Intensity
162.0117340	0.80
170.1002045	0.02
173.1636047	0.02
177.7489319	0.02
178.3840179	0.08
182.0056763	0.14
183.9943542	0.05
193.9529266	0.16
210.0321655	0.19
214.1561890	0.13
219.3958130	0.04
227.0772400	0.06
228.1528320	0.27
230.9806519	0.20
233.1142578	0.14
234.4103699	0.10
239.2653046	0.07
245.8905334	0.25
248.0881958	0.02
251.2629089	0.10
252.2663574	0.07
256.0844421	5.67
257.1632385	0.14
261.4982605	0.06
268.6365356	0.27
269.2911072	0.22
271.1156311	0.33
273.0677490	3.29
274.2902832	0.12
279.0748291	0.02
285.4323730	0.22
287.2255249	0.03
288.0577393	0.15
290.0769653	0.08
291.2020264	4.86
294.1428833	0.05
295.2815552	0.04
296.1208496	0.16
296.9813843	0.02
301.1983643	0.14
302.0991821	0.04
303.1588135	0.68
312.9492188	0.40
325.2986450	0.19
328.1323853	0.04
331.0562744	0.04
335.0758057	0.77
339.0232544	0.08
342.1411743	0.22
343.1108398	1.74
344.1671143	0.06
347.1713257	0.16
352.3588867	0.04
355.9183960	0.11
357.2337036	0.10
358.8013306	0.18
360.2084961	0.06
370.1563110	0.10
371.1561890	0.17
372.2780151	0.06
374.0631104	0.12
375.0373535	0.60
376.1279907	0.02
377.2160645	1.57
380.9074707	0.11
383.2271118	0.03
384.0795288	0.10
385.7437744	0.01
386.3776245	0.14
388.3622437	0.16
389.3818359	0.09
392.2919312	0.32
394.1799927	2.01
399.1547241	1.07
400.0446167	0.18
401.2237549	0.07
402.1159058	0.31
416.0380859	0.82
417.1209106	5.40
420.0186768	0.04
420.9143066	0.13
434.2324829	100.00
442.6361694	0.04
450.0357666	0.13
455.1488037	0.02
459.6848145	0.05
461.2691040	0.06
464.8283081	0.10
471.0256348	0.19
472.6602173	0.39
473.2839355	0.37
475.4556274	0.04
482.2474365	0.08
489.4380493	0.03
491.3976440	0.06
499.5043335	0.10
500.3652344	0.21
501.1981201	0.05
505.1881714	0.17
506.5216064	0.03
517.4325562	0.13
518.1015015	0.09
519.3504028	0.19
521.5962524	0.06
522.2297974	0.02
526.7868652	0.13
527.7725830	0.30
529.2736816	0.09
532.9458618	0.40
545.2641602	3.36
546.1986694	0.15
549.4334106	0.02
554.1453247	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	332.0986
Annotation	Unknow
Peak:m/z	Relative Intensity
112.0017853	0.24
114.2713470	0.08
117.1336594	0.52
125.9413300	0.08
134.8703156	0.18
140.2123413	0.11
152.0523376	0.37
168.1676636	0.44
170.1721344	1.88
175.0347290	0.06
181.3221436	0.12
182.1155853	0.14
184.2722626	0.31
209.3027039	0.23
212.1327820	37.95
214.0714111	100.00
218.1778259	0.11
224.1863098	0.38
230.1880798	0.33
242.0395203	4.32
243.2527466	0.06
252.1896057	0.24
254.1799622	0.39
257.9517212	0.20
270.5475464	0.16
272.1080627	48.60
273.1279297	0.09
273.8609619	0.15
285.9367065	0.38
288.1237183	0.32
296.2689209	0.68
302.2307434	1.13
303.4391479	0.16
314.1757812	3.40
316.2645874	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	565.11
Annotation	Unknow
Peak:m/z	Relative Intensity
165.0450439	0.04
209.8065491	0.22
219.0348206	0.08
238.0873413	0.10
254.1256104	0.13
263.9956665	0.03
265.9235229	0.29
269.1341248	0.12
270.0908203	0.23
298.2414551	0.05
309.8435059	1.45
310.5496216	0.08
317.0717163	0.12
320.8494263	0.11
324.2054443	0.04
327.5262451	0.06
336.9953003	0.06
340.0642090	0.06
341.0771484	0.06
341.8828735	0.02
351.2298584	0.14
357.9096680	0.05
363.8306274	0.08
367.0545654	0.06
371.9957886	0.10
373.0704956	0.14
380.0419922	0.07
381.9027710	0.28
383.1780396	0.42
383.9965820	0.07
385.1652832	15.61
387.8306274	0.13
392.7901001	0.29
399.0110474	1.24
399.9765015	1.64
405.1309814	0.04
412.9496460	0.12
414.7160034	0.06
417.2102661	1.56
418.1345825	0.09
425.2165527	0.03
430.9998169	4.15
432.1151733	1.01
433.1985474	0.14
434.3547974	0.04
437.4066162	0.79
438.3424072	0.15
445.2147827	0.04
449.1474609	0.57
456.8896484	0.09
458.0572510	0.07
459.9613647	0.06
472.2068481	0.05
473.2609863	0.91
474.9397583	100.00
475.6502075	0.09
477.7514648	0.04
505.9996948	0.15
507.0142212	3.06
511.4188843	0.04
515.3513184	0.07
518.2847290	0.04
519.6672363	0.69
520.4407349	0.01
528.6507568	0.12
533.1218872	0.04
535.9674072	0.04
545.8284912	0.04
546.4466553	0.04
547.2603149	0.49
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	693.2029
Annotation	Telephiose C
Peak:m/z	Relative Intensity
221.0156097	0.14
235.1968231	0.38
240.8918610	0.16
323.2515869	0.64
337.0633545	4.21
355.4114380	0.04
419.3115234	0.34
438.2297363	0.13
440.1902466	0.19
445.4530640	0.11
463.4772339	0.20
471.5059204	0.27
481.2657471	0.05
499.4677734	0.20
506.3898315	0.13
518.4559937	0.14
525.4036255	2.18
531.1992798	100.00
531.8672485	0.23
545.4395752	0.31
551.1378784	0.13
559.2352905	0.65
563.7802124	0.29
564.4323120	0.09
573.2041626	2.20
573.8421631	0.07
576.3729858	0.06
577.3145142	0.23
597.0532227	0.09
601.4192505	0.17
603.2025757	0.38
604.2964478	0.28
605.1456909	0.16
611.4777832	0.09
619.4299927	0.08
630.0449829	0.08
633.0434570	0.54
646.3496704	0.22
647.1189575	0.62
649.7750244	0.19
651.4425049	0.35
652.2551880	0.20
659.0666504	0.31
670.1643677	0.21
671.1552124	0.12
672.5392456	0.14
674.4841919	1.00
675.3110962	0.47
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	354.08
Annotation	Unknow
Peak:m/z	Relative Intensity
108.9702148	0.05
111.9495544	0.18
119.7114258	0.25
121.9433746	0.56
129.9115295	2.39
130.9137878	0.07
141.0676270	0.08
145.0092621	0.05
165.9531708	0.28
166.8405457	0.12
175.2681885	0.05
176.0367126	0.09
177.0550232	6.61
191.3530731	0.11
192.3147888	0.04
195.8027802	0.07
196.9772644	0.07
207.8569641	12.35
209.0825958	0.11
215.9731140	0.14
217.2610779	0.21
222.1587219	0.05
222.8535156	0.03
225.0562134	100.00
234.0178833	0.10
238.9854736	0.07
242.9483643	0.11
244.8373413	0.10
252.0202026	0.72
260.9959106	0.98
262.2136536	0.30
264.1631470	0.15
266.1589661	0.06
266.9336548	0.08
268.1004944	0.09
272.1448975	0.24
273.0963745	0.23
275.7186890	0.05
278.9805603	8.59
279.7626953	0.04
281.2902222	0.05
289.3017273	0.05
291.1801758	0.73
295.0932617	0.08
302.0696716	0.10
308.0622864	0.10
309.7007141	0.11
310.3711548	0.09
312.6255493	0.07
313.3532104	0.09
317.2514954	0.23
318.1235657	0.32
335.9791870	3.96
336.8751221	0.97
337.6697693	0.29
344.3073425	0.19
344.9563293	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	247.1282
Annotation	Leucyl-Aspartate
Peak:m/z	Relative Intensity
71.8996582	12.31
117.9675446	100.00
129.9170685	1.67
135.1823883	0.05
139.1080780	0.06
147.9881287	0.49
184.0475769	4.34
190.9671173	0.04
201.0879059	0.73
210.9916840	0.27
222.0957184	0.77
229.0833893	8.60
230.0583496	38.97
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	493.17
Annotation	Unknow
Peak:m/z	Relative Intensity
157.9060669	0.38
159.0027008	0.76
170.0141144	0.10
178.0669250	0.12
185.0065460	0.17
188.9359131	0.18
194.1875916	0.13
196.2246399	0.48
212.1437073	0.08
218.0933075	0.03
232.1778564	0.03
245.1170959	0.21
255.4126892	0.20
257.1040039	3.14
261.2038879	0.06
263.0777283	0.25
265.9483643	0.32
274.1178894	19.39
297.9872437	0.53
299.1661377	0.06
300.8795776	0.04
301.8737488	0.28
302.4990540	0.10
306.1406860	1.24
313.4361267	0.32
315.1290283	0.19
316.2207336	8.56
317.2876282	0.66
319.2752075	0.10
329.3101807	0.20
330.3337402	0.37
331.2183533	0.26
337.5401306	0.07
340.2946167	0.10
341.3645630	0.05
346.9592590	0.38
348.0723267	0.08
361.5959778	0.11
364.1405334	16.70
367.2301636	0.17
373.7892151	0.05
375.2932129	0.48
376.3229980	0.31
377.9461365	0.49
378.6083374	0.24
385.3084412	2.38
386.3639832	0.05
388.0932617	0.35
389.4906616	0.10
403.2170105	100.00
403.8757629	0.74
429.1327209	0.15
435.2287292	6.42
439.1945801	0.34
439.9180908	0.05
447.1507263	0.58
448.2186584	0.44
449.1788635	0.35
451.3390503	0.52
452.3006592	5.32
464.7710266	0.36
470.7670593	0.17
474.3454895	0.25
475.2300110	2.87
476.2968445	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	218.1034
Annotation	Pantothenic acid
Peak:m/z	Relative Intensity
70.9154434	0.73
87.9037323	100.00
89.0268250	0.08
115.8337097	0.17
123.9948120	0.06
128.2122955	0.05
146.0653381	11.40
155.0425262	0.04
156.2006073	0.06
157.1800842	0.07
157.9772797	0.14
172.0689392	0.07
174.0761566	0.08
177.0130615	0.13
184.0966034	0.06
190.0952759	0.32
199.1789398	0.13
200.2578278	0.34
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	305.08
Annotation	gamma-Glutamyl-S-(1-propenyl)cysteine sulfoxide
Peak:m/z	Relative Intensity
87.9461288	0.08
89.0366211	0.28
110.9720612	0.33
114.8711929	0.04
125.1120758	0.36
127.9983368	30.46
128.9570923	0.10
130.1966095	0.06
133.0946350	1.47
134.8117065	0.07
141.8750305	0.08
151.1567688	0.29
152.8904114	1.12
154.0861511	0.07
169.1102905	9.76
171.1243591	9.81
176.0758362	11.20
179.0831299	0.47
184.0419922	0.12
185.1551819	2.66
196.9118195	0.59
200.0769958	0.08
201.9809265	0.06
203.0766602	2.55
213.1521912	1.62
215.1515503	18.85
218.2005310	0.31
219.7653809	0.17
222.2143250	0.03
229.0105591	100.00
231.1750488	0.29
246.9797668	14.01
264.1085510	48.42
268.9323425	0.37
287.0570068	36.13
287.6696777	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	294.06
Annotation	Unknow
Peak:m/z	Relative Intensity
88.0693588	0.19
95.9385071	0.23
102.1704254	0.09
104.8240051	1.33
109.1128845	0.03
110.2177963	0.15
113.8613434	7.68
116.0019531	0.22
118.9513550	0.08
119.6737976	0.05
122.0412598	0.03
128.0021667	0.54
129.9987793	0.44
133.0833282	0.08
136.9515076	7.63
138.1078186	0.10
142.1216125	1.00
145.0325623	0.07
146.0489197	0.06
149.2185669	0.09
152.0917511	0.07
155.1126099	0.03
159.0254517	0.04
162.9497223	0.13
164.9015961	0.14
166.0375214	0.20
170.0499268	0.05
173.9457092	0.54
175.9644775	0.09
178.8687592	23.62
179.4738007	0.07
181.1894226	0.07
188.0856628	100.00
189.1564026	0.25
189.8969421	0.07
191.8560028	0.23
193.9689484	0.11
196.0480347	0.12
198.3208313	0.08
203.8672485	0.20
206.1491089	0.15
207.1515808	0.07
209.1781311	0.08
210.1096191	0.16
214.0332642	0.05
216.0552673	0.05
219.9725647	27.09
221.0431213	0.44
225.1324158	0.13
230.1334839	0.23
232.2708130	0.18
233.0655823	0.05
235.3638916	0.06
237.1411438	0.07
238.0919800	0.02
239.1583252	0.05
245.3999023	0.04
248.0478516	0.44
249.2942200	1.32
250.1853638	0.42
250.8775635	0.14
253.0562134	0.60
258.0087891	0.04
265.3650208	0.29
266.4000854	0.22
271.0714722	0.25
272.4461060	0.04
275.5188293	0.52
276.2327576	1.87
277.1199951	0.33
284.7113037	0.37
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3alpha,5beta,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
96.97332764	0.89
104.8144684	1.01
106.9580154	1.23
111.1021271	1.32
112.9901047	7.50
115.0110168	0.26
118.8395538	0.51
121.0771637	2.44
123.0857849	1.00
124.9884644	0.34
127.007019	1.18
128.9375305	0.86
130.9333954	2.21
132.8205109	1.01
135.0510559	5.65
137.0613861	4.85
143.0427551	3.25
143.8593597	0.71
144.9670105	6.98
147.0569763	2.00
151.0686035	0.36
152.9808044	1.46
154.9653778	0.83
156.8496399	4.00
158.1431885	0.72
159.0336609	1.58
160.9994812	2.85
162.8459778	0.26
164.9011841	1.36
166.6452942	0.88
168.9464722	2.74
171.085434	0.31
171.7680969	0.41
173.045639	4.39
174.5203552	0.74
175.2005768	1.05
176.8896332	1.47
179.1644287	0.98
183.1567688	3.65
187.1919861	3.20
189.8479919	0.64
191.1118317	0.50
192.1018066	0.20
192.9953918	1.66
194.8442993	3.25
197.0853119	0.35
198.2481689	0.31
201.3270264	0.21
202.9170685	2.23
205.1531067	1.46
208.9439697	1.28
211.019104	2.58
217.0769043	1.83
218.9589539	6.53
221.2465515	0.80
223.1812439	2.22
224.3523254	0.17
225.0773926	0.42
228.8681641	0.63
231.1225281	0.70
233.0537109	0.18
234.9206238	2.47
235.8454895	0.16
238.5298157	0.92
240.89505	0.36
245.1671753	3.55
246.8470459	0.46
247.483429	3.11
251.0602722	0.32
253.3241272	1.02
255.3394775	0.57
257.3656921	0.58
259.0520935	0.67
263.2637329	0.40
266.8534241	11.54
269.065094	0.31
271.3414917	2.11
273.203064	0.56
277.1623535	0.97
277.79953	0.73
281.303833	2.05
283.3128662	0.28
287.2589722	2.12
291.3222656	0.85
295.5384216	2.39
299.2774963	1.48
300.0164795	1.18
303.3179932	0.24
305.259491	5.68
306.2841797	0.41
313.2002563	4.67
323.2467346	100.00
325.1289673	0.86
332.3840637	0.19
337.1081848	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	322.0593
Annotation	Unknow
Peak:m/z	Relative Intensity
98.1125488	0.26
99.2477875	0.38
99.9496231	4.61
102.8446884	1.78
107.8720093	14.18
110.8848495	5.39
112.1608353	0.12
113.9223938	0.06
123.7451859	0.10
125.9072113	100.00
127.0580521	0.58
129.0702057	0.03
130.8796387	0.09
141.0215302	0.09
144.9276428	7.28
157.9655457	2.27
160.1227112	0.35
161.9699402	0.06
168.0658875	0.83
171.8363647	1.15
176.9392395	0.03
178.1640320	0.11
179.9587402	0.06
189.8400879	7.66
191.1769562	0.07
191.9094849	0.42
193.9549713	0.28
196.4152679	0.15
197.0911560	0.02
198.0747223	0.36
200.1055603	0.03
203.9450073	0.37
206.2318420	0.07
207.2649841	0.03
213.7965698	0.18
215.9176636	41.04
230.1929321	0.34
231.2145996	2.36
231.9270325	18.13
240.9185791	0.11
247.9793701	8.25
248.9295349	0.06
250.0909424	2.31
254.0357361	0.22
261.0545654	0.04
262.1984253	0.09
263.0520020	0.16
263.9390869	0.47
266.2080383	0.12
272.2262268	0.03
275.8789978	0.28
276.5240479	0.15
277.5097656	0.19
280.4344482	0.06
281.4072266	0.07
287.0838623	0.22
290.1151733	0.30
303.0798035	0.92
304.2483826	0.37
305.1654663	0.32
312.3265381	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	842.178
Annotation	Unknow
Peak:m/z	Relative Intensity
265.1791992	0.38
277.2653198	0.11
306.0045166	0.04
337.1129761	0.03
371.5908203	0.20
373.8851318	0.11
387.2727051	0.17
396.3840332	0.05
403.0187988	0.12
409.3165283	0.30
417.0606079	0.19
422.1315918	0.31
429.3228149	0.11
431.2304688	0.28
433.2548218	0.16
434.3762817	0.08
440.0577393	0.50
445.2778931	0.13
449.2998047	0.15
457.3905029	0.11
458.2387085	0.26
464.2240601	0.17
485.1953125	0.05
492.2637939	0.13
495.2770996	0.03
503.3330688	0.26
505.6917725	0.15
509.3218384	0.52
514.9498901	1.29
515.6092529	0.12
517.0909424	0.09
535.3417969	0.04
537.5155640	0.07
538.2894897	0.12
539.4119263	0.06
542.4847412	0.04
544.4033813	0.09
546.2832031	0.31
550.8908691	0.09
554.3724976	0.04
556.2475586	0.13
557.2007446	0.08
564.3739624	0.92
565.1448364	0.08
569.1974487	0.44
575.2017212	0.35
578.1870728	0.21
579.3738403	0.12
584.1594849	0.92
592.1211548	0.20
593.0253296	0.22
594.3967896	0.73
596.3650513	0.11
598.4470825	0.12
602.1328735	0.17
607.3440552	0.34
610.0653076	1.20
612.1930542	1.24
615.0820312	0.31
620.1105347	1.57
621.2713013	0.31
626.3042603	4.32
638.1260986	28.63
638.8867798	0.17
643.6820068	0.77
644.4997559	0.90
645.8981323	0.08
647.0066528	0.17
648.4739990	0.12
649.3726196	0.19
657.1530762	0.19
660.1082764	0.11
667.5553589	0.54
668.1813354	0.39
685.3403320	0.28
686.2261353	0.09
693.2213135	1.01
695.1314697	0.99
704.0941162	0.46
710.3439331	0.06
713.1934204	100.00
713.8587646	0.12
717.6298218	0.08
721.2412109	1.10
721.8908081	0.10
726.6409912	0.05
731.1730957	0.04
739.1724854	0.29
749.1492310	2.21
752.1708984	0.06
760.9501343	0.08
767.1632690	14.85
767.8816528	0.09
778.9354248	0.14
790.2961426	0.29
792.7080078	0.11
794.6237183	0.09
800.0161743	0.33
801.5081787	0.08
824.2796021	9.45
825.1362915	0.04
833.2103882	0.25
842.4519653	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	291.1001
Annotation	N-gamma-Glutamyl-S-allylcysteine
Peak:m/z	Relative Intensity
115.8714371	0.67
117.2480316	0.05
119.9384384	0.14
130.0617371	0.36
132.8630066	0.05
134.0189209	0.10
144.8888245	54.17
148.0894775	0.14
161.9892578	100.00
217.0075073	0.19
228.1047668	1.45
244.7608337	0.25
249.1516113	0.14
254.9287720	0.23
273.3512878	1.02
274.1547241	5.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	207.051
Annotation	Dihydrolipoate
Peak:m/z	Relative Intensity
72.7827377	0.17
83.0065460	0.26
88.7593079	0.25
100.1494141	0.04
101.9717865	0.32
113.0095520	0.11
115.0012512	0.28
116.9890442	100.00
127.1059723	0.40
129.0071564	0.16
130.9714966	0.12
140.9022675	1.16
142.7999573	0.03
147.0359802	0.02
158.9617615	2.25
161.0057526	0.54
188.9658813	20.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	693.2032
Annotation	Sesaminol glucosyl-(1->2)-glucoside
Peak:m/z	Relative Intensity
192.9136658	0.26
193.8524017	0.10
202.2390137	0.07
203.1281281	0.07
214.1734619	0.06
215.1194458	0.10
217.1560059	0.24
217.9185638	0.03
221.3834839	0.11
222.0220337	0.03
231.1459503	0.22
233.2335205	0.11
235.1577606	2.23
236.2628784	0.56
241.5728149	0.09
245.1388245	0.41
246.2250061	0.06
247.2895203	0.05
247.9626617	0.05
253.3088989	0.01
257.2390747	1.02
258.1315002	0.07
259.2162781	0.96
260.2943420	0.31
261.0743103	0.08
263.0219727	0.09
272.1895752	0.08
273.1699524	0.04
275.2345276	0.54
276.2889709	0.04
281.1978455	0.05
283.1878052	0.11
284.3057251	0.07
287.2438965	0.04
288.3322144	0.10
295.1934509	0.15
301.1935425	0.26
303.1248169	0.04
305.0710144	0.08
306.1208801	0.05
319.1237793	0.98
323.1811523	0.15
337.1909790	0.62
338.0222778	0.16
355.4080200	0.05
372.3060913	0.02
377.2672729	0.03
379.4171143	0.02
398.2426147	0.02
401.3438110	0.06
407.4317627	0.02
411.2949829	0.05
421.5124512	0.02
439.1054077	0.03
457.3383789	0.06
458.0568237	0.15
459.6975098	0.02
463.3804932	0.02
467.3940430	0.05
481.1616211	0.33
485.3057861	3.14
486.1893311	0.59
499.2114868	100.00
500.2827759	20.85
504.1072998	0.04
513.2674561	0.52
514.2047119	0.04
517.4865112	0.03
523.5091553	0.03
531.3593750	0.34
532.1094360	0.19
538.2568970	0.07
547.5258179	0.03
548.9872437	0.03
575.7022095	0.04
578.4686279	0.03
579.5468140	0.10
609.5617065	0.12
612.1414185	0.03
614.6571655	0.04
620.6062622	0.02
632.0756226	0.07
639.7286987	0.08
648.1047363	0.10
649.5208740	0.81
650.6741333	0.07
651.6008301	0.27
653.3160400	0.54
656.1919556	0.03
661.2426147	0.08
675.4800415	0.43
676.2161865	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	382.1092
Annotation	Unknow
Peak:m/z	Relative Intensity
111.9761276	0.32
114.2329865	0.02
130.0223999	3.35
130.9413452	0.03
133.1721802	0.02
149.9908447	0.68
162.8024750	0.07
177.0625916	2.71
179.2376404	0.01
182.1847382	0.05
190.0885620	0.04
196.0603790	0.24
205.2870483	0.05
209.3335724	0.03
210.9763489	0.05
218.9942627	0.05
225.1578064	0.07
231.2064819	0.02
233.8374329	0.04
235.9266052	12.16
247.9727173	0.06
251.2558899	0.18
252.9790039	100.00
253.5970154	0.41
254.7255249	0.03
259.8366089	0.09
268.4306946	0.05
277.1442871	0.04
279.0015564	0.02
281.2532043	0.05
286.0846558	0.05
288.4314575	0.15
289.0634155	0.78
290.3008423	0.05
291.9822693	0.18
293.3358154	0.23
297.3721313	0.08
302.3039856	0.08
307.0656738	9.17
308.0292358	0.05
310.2053833	0.04
319.1701660	2.06
320.3125000	1.16
323.2867737	0.09
325.1059570	0.02
327.4426880	0.02
328.2679749	0.05
335.2796936	0.25
336.5999146	0.42
337.2621765	2.83
338.3117065	0.65
340.1423340	0.02
345.1993408	0.45
346.3519897	0.36
349.1260986	0.08
351.0340881	0.07
353.9141846	0.07
363.2356873	16.60
364.3070679	8.57
365.2553406	0.33
373.3008423	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	424.1704
Annotation	Unknow
Peak:m/z	Relative Intensity
120.0141449	1.16
130.0577393	0.34
131.0640869	0.04
132.0946655	0.02
148.8286896	0.20
150.1940002	0.05
150.8948975	0.08
158.4612579	0.08
163.9468994	0.06
166.0272827	16.41
171.7440491	0.01
175.0520935	0.02
181.5618591	0.07
185.9304199	0.22
187.1769409	0.02
201.9865417	0.08
208.1192932	0.05
210.0148926	0.05
216.1103668	0.04
223.3125305	0.10
231.3370819	0.08
232.1225739	0.98
235.8738708	0.13
240.1446533	0.06
241.2033386	0.71
242.0959473	0.05
244.2384338	0.03
248.0748596	0.07
248.9544067	0.54
258.8986511	0.90
261.1415405	0.02
271.1587524	0.01
272.3835144	0.05
273.3158569	0.02
274.5178833	0.05
275.1426086	0.10
276.1235352	0.03
277.1983032	1.15
278.1501465	1.32
286.2507935	0.04
291.0911255	0.04
291.9954834	0.11
293.2554932	0.08
295.1428223	100.00
295.9251709	0.03
302.9874268	0.50
318.2826233	0.04
330.1446533	0.02
331.6660156	0.09
333.9762268	0.43
350.2039795	0.02
358.8421326	0.09
359.8676758	0.02
361.1069946	0.62
371.6797485	0.12
372.5171509	0.06
377.3036499	0.05
378.4151001	0.29
380.0269775	0.03
382.3417053	0.04
383.0625305	0.12
388.1252747	0.24
388.7814331	0.11
389.4217224	0.04
393.6221008	0.05
405.0417175	0.19
406.2077637	1.67
407.3124695	0.67
414.1453552	0.03
415.3666687	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	682.1345
Annotation	Unknow
Peak:m/z	Relative Intensity
197.1198425	0.34
229.0635681	0.07
231.0536041	0.11
232.2866211	0.05
238.0893707	0.07
243.1553192	0.04
252.0222778	0.03
254.1390076	0.36
255.1265717	0.36
255.8405151	0.03
266.0765686	0.13
272.2572632	0.21
286.1205139	0.15
288.0373230	1.18
289.1734009	0.14
297.2597656	0.04
300.2059631	0.05
301.2069702	0.16
302.5609131	0.08
304.1705933	0.24
305.3005371	0.19
306.1874390	0.19
307.2113647	0.10
311.2765503	0.04
314.0496826	0.06
315.3063965	0.29
316.1352844	0.29
319.0952759	0.05
319.7274780	0.15
320.3622437	0.04
321.2418823	0.03
323.2477417	0.57
324.2049561	0.15
326.1366882	0.25
329.1618652	0.07
335.2744751	0.04
339.2499390	0.05
340.2231445	0.06
341.3948364	0.88
342.3346252	0.09
344.1593933	0.05
347.2000732	0.02
351.7573853	0.08
352.4424438	0.07
354.3860474	0.08
355.1162109	0.23
356.3164062	0.09
357.2345581	0.10
360.1322021	0.58
361.1514282	0.09
370.2020264	0.04
373.2703857	0.37
375.1452026	0.23
376.1862793	0.25
378.0413208	1.50
379.0435791	0.30
382.4166260	0.02
383.2164917	0.33
384.1885376	0.16
388.4887085	0.04
390.3997192	0.04
395.3760376	0.06
405.2058105	0.68
406.0686035	0.27
407.1038818	0.31
407.9901123	0.20
408.6416016	0.17
409.3852539	0.04
415.0113525	0.05
416.0136719	0.19
416.6977539	0.03
417.3790894	0.13
418.4105835	0.13
424.2434692	0.13
425.1557007	0.03
426.2330933	0.44
427.0175781	0.12
429.1767578	0.61
430.1740112	0.20
432.0871582	0.39
433.1085815	0.49
434.3063354	0.36
435.5785522	0.07
438.3530884	0.09
440.2854614	0.08
442.2391357	0.11
447.1249390	8.15
448.2192993	2.07
449.4652710	0.12
450.2739868	0.48
452.1599731	1.92
453.2017212	0.40
456.9833984	0.05
458.1894531	0.36
459.2829590	0.03
461.4116821	0.04
462.1462402	0.12
463.1458740	0.03
466.3187866	0.02
467.8722534	0.12
469.6853027	0.40
470.3218994	4.85
471.4339600	1.85
473.8555908	0.21
479.0674438	0.19
480.1655273	0.18
481.2113647	0.18
481.8421631	0.03
482.4758301	0.05
484.1209717	0.72
485.1359863	0.09
486.1786499	0.46
487.1992798	0.09
489.2042236	2.00
490.1008301	1.08
491.4342041	1.05
492.2762451	0.56
500.6442261	0.35
501.4926147	1.11
502.2455444	0.87
503.2948608	0.11
504.3073120	0.74
505.5394287	0.95
512.0296631	0.17
513.2429810	0.18
514.1198730	0.43
515.0933228	0.46
516.4927979	0.36
517.1732788	1.50
518.3338013	0.77
519.2481689	0.14
521.0610962	0.12
522.6629028	0.20
523.4563599	0.10
524.2844849	0.39
525.3461304	0.22
526.3461304	0.38
527.2380981	0.04
531.6480713	0.21
532.3013306	1.62
533.5358276	0.50
535.1534424	7.24
536.2261353	24.00
537.2758179	4.96
540.2717896	0.83
541.1174927	0.56
542.4089966	0.03
544.2965088	1.40
545.1567383	0.31
546.3001099	0.09
547.0962524	0.02
549.2854614	0.07
550.2224731	0.43
551.3749390	0.24
552.1915283	0.02
553.0928345	5.06
554.1953125	1.61
558.2141724	28.17
559.2871704	8.23
563.2493286	0.23
564.1262817	0.20
567.1694946	1.48
568.1729126	21.23
569.2407837	7.96
570.1080933	0.50
574.3810425	0.03
576.2359009	100.00
577.2084351	32.14
578.1176147	0.07
581.4470825	0.12
590.1497192	0.99
591.1759644	0.85
592.1698608	1.08
593.3442993	0.14
595.7441406	0.31
596.4522705	0.09
597.5615234	0.03
598.4113159	0.04
600.3054199	0.84
601.0673218	0.66
604.5583496	0.06
605.8291016	0.02
606.4976196	0.03
607.5792847	1.20
608.2031860	11.83
609.3208008	4.60
610.2343140	9.84
611.3224487	3.54
623.1250000	5.43
624.1912231	2.11
625.0889282	0.14
638.5393677	0.07
641.1161499	73.53
642.0911255	24.62
642.7606201	0.09
646.2198486	0.60
647.2365112	0.06
664.1220093	27.88
665.1721802	11.44
667.3970337	0.33
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	410.0518
Annotation	Unknow
Peak:m/z	Relative Intensity
128.0635986	1.21
141.1447449	0.27
142.9580383	2.12
146.2199554	0.04
156.9173279	0.08
160.0633850	0.22
164.0286560	0.05
166.1903992	0.05
167.1336365	0.03
169.0970764	0.23
175.0312195	1.12
179.1121826	2.16
182.2243958	0.10
184.9705658	0.31
187.2262573	0.04
197.0727539	1.23
197.8264618	0.02
203.1179199	0.77
208.2226868	0.18
209.1343384	1.09
210.1998901	1.19
224.0678406	0.21
226.1499786	0.48
228.1791382	0.16
229.1359253	0.17
230.3648987	0.22
236.1378784	0.05
244.0843811	0.04
252.0859070	0.66
252.9452820	0.11
254.1805420	12.27
260.3117676	0.59
262.9837952	0.19
270.1845093	0.08
272.1530151	81.11
281.2102051	0.18
286.1209106	11.54
302.1130981	0.08
304.1965942	100.00
306.1316528	0.34
310.8317871	0.05
317.0038757	0.03
319.9969177	4.58
321.1901550	0.06
336.1737366	0.18
338.0420227	72.00
338.6820984	0.23
344.2320862	0.07
346.2570801	0.04
361.3704529	0.13
363.6618042	0.02
365.7195740	0.31
369.0163269	1.04
390.7775574	0.08
392.1420593	11.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	323.072
Annotation	L-gamma-Glutamyl-S-allylthio-L-cysteine
Peak:m/z	Relative Intensity
104.8070984	3.74
111.8839874	0.06
120.0345612	0.27
129.8249969	0.52
130.7899780	0.10
148.0308838	0.48
151.8739014	42.25
176.3484802	0.56
176.9647827	2.33
181.1551666	0.06
187.9486237	0.02
193.9342041	100.00
200.0264435	0.06
202.0010376	0.09
217.0344543	1.58
231.2176208	0.11
249.1303711	2.77
259.9230957	1.05
276.9759827	0.45
282.0924988	0.36
287.1994019	0.12
288.2834473	0.07
305.0602112	2.62
306.0942383	7.99
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	448.1217
Annotation	Unknow
Peak:m/z	Relative Intensity
127.9614258	1.13
136.9318542	0.09
138.1286774	0.12
146.0367279	0.17
148.8979034	0.08
153.0820312	0.60
155.0505371	5.33
159.9001312	0.54
176.2008057	0.36
177.1394653	0.17
179.0988770	1.44
185.0885010	0.06
186.0316467	0.12
190.0746765	0.30
194.0899200	1.54
195.1118469	0.41
196.1736298	1.02
197.0943451	2.23
198.2875366	0.16
220.1788635	0.14
222.0835266	3.22
229.0508118	24.79
230.9052429	0.15
238.2210999	1.19
239.1303711	0.83
240.1008301	4.53
241.1615906	2.72
256.3159180	0.07
257.2085266	0.40
263.9925842	0.72
266.2401733	3.00
268.1017456	2.01
269.1749268	0.18
269.9498291	0.07
272.1018677	6.29
275.3697815	0.14
284.1557617	4.68
286.3626099	0.18
287.1936340	0.13
293.5984497	0.10
296.0693359	2.53
298.0754089	3.03
299.1163940	0.42
300.9523621	0.35
310.1024170	0.07
312.1121216	5.74
314.2529297	55.37
316.2050781	0.64
317.2654114	0.12
319.2361145	3.36
329.0697021	0.10
331.2109375	0.32
332.1306152	0.24
333.2476807	0.08
338.1941528	3.52
340.1818848	6.89
340.8105469	0.08
346.2319946	9.85
352.1304932	0.10
356.2708740	0.62
358.1575317	100.00
358.7616882	0.40
367.9786987	0.19
370.2575684	0.67
372.1084595	1.41
374.2086182	9.10
379.8727112	0.06
385.4167175	0.07
390.1644287	47.02
396.4385681	0.15
401.8519592	0.13
403.2595825	0.41
404.4192810	0.47
407.1162415	47.60
412.2416687	0.26
412.9926453	0.63
418.3455200	0.27
429.2630310	1.15
430.1658020	9.45
431.0944519	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1089
Annotation	Lactulose
Peak:m/z	Relative Intensity
100.8634338	6.49
106.9761200	0.33
112.9909668	23.01
115.1126022	0.18
118.9942703	14.91
124.9961777	4.02
130.9364624	13.46
138.5000153	0.92
142.9386292	28.22
148.8977356	2.25
160.9557648	22.64
176.1408081	0.71
177.1370392	1.33
178.8940735	100.00
181.4823761	0.11
209.1770020	0.90
220.8837280	0.37
245.1217957	0.21
250.9875488	0.21
262.3943481	0.20
281.0036621	2.27
297.3000488	0.64
323.2750854	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	829.2406
Annotation	Sesaminol 2-O-triglucoside
Peak:m/z	Relative Intensity
259.2713318	0.16
297.3945923	0.10
300.6740723	0.10
305.2479858	0.04
311.1394348	0.08
323.1518555	0.08
333.2909241	0.23
355.4691162	0.05
375.0058594	0.12
412.9216309	0.12
427.3690796	0.06
443.1795044	0.34
473.3282471	1.73
481.4453735	0.12
485.5529175	0.10
487.2299805	0.21
494.6815796	0.04
499.3116455	8.91
505.4726562	0.23
529.2847900	4.43
536.3918457	0.17
572.6005249	0.09
575.2891235	0.14
601.3275757	0.19
604.1780396	0.17
621.1212158	0.05
631.4581299	0.06
639.1198120	0.09
646.3880615	0.07
649.5317993	0.32
657.4152832	0.08
662.2982788	0.09
665.2623291	0.12
667.2217407	100.00
667.8449097	0.72
681.7517700	0.15
709.2457886	0.90
710.4580688	0.04
719.5382080	0.19
724.2659302	0.19
739.2653198	0.08
766.1453247	0.06
769.0161743	0.45
781.6894531	0.29
782.9418335	0.11
784.4012451	0.13
785.4567871	0.47
787.0952759	0.15
793.6105957	0.25
798.9467773	0.18
808.6936646	0.12
810.0411377	0.10
811.4010620	0.37
814.4070435	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	575.2196
Annotation	Unknow
Peak:m/z	Relative Intensity
231.8772125	0.09
235.1797943	0.04
242.0180054	0.20
342.0231934	0.09
343.1820068	0.07
355.0698242	0.11
367.2641602	0.16
373.4797363	0.09
375.1702881	0.02
382.4574585	0.09
395.2599487	0.12
410.1541138	0.12
412.2469482	0.12
421.1708984	0.05
422.3388062	0.04
428.0310669	0.08
429.3641357	0.13
455.1491089	0.02
466.2892456	0.22
467.8939209	0.03
472.1613770	0.11
472.8040161	0.22
480.1006470	0.05
482.4394531	0.47
483.5540771	0.08
487.3483276	0.19
500.5871582	0.21
512.5243530	0.04
513.1658325	0.06
515.3070679	0.03
515.9318237	0.09
529.2802734	100.00
530.0253296	0.20
531.1817017	0.12
555.7606812	0.22
556.5752563	0.80
557.3963013	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	479.1178
Annotation	Pedaliin
Peak:m/z	Relative Intensity
148.9862518	0.12
193.9700317	0.01
224.8973083	0.05
228.5061035	0.01
232.0516205	0.02
239.2578278	0.02
251.2060242	0.02
255.1083679	0.01
259.1542969	0.04
280.0325623	0.03
283.0910950	0.01
289.3313293	0.03
299.0828857	0.02
301.2835693	0.02
310.3016968	0.09
315.0977783	0.01
317.0984497	100.00
325.6299133	0.05
330.8464355	0.13
333.1655273	0.02
347.1021118	0.01
359.1497498	0.48
359.8562317	0.07
371.3286743	0.01
374.1079102	0.01
375.7068176	0.07
383.2823181	0.14
387.1972961	0.03
388.2101135	0.07
389.4056091	0.10
397.1805115	0.06
409.8104553	0.01
413.1812439	0.05
414.0999756	0.03
415.1823425	0.01
425.3155212	0.02
429.3612061	0.04
432.0910950	0.06
434.3725281	0.07
435.4128113	0.04
438.2290039	0.03
443.2320251	0.13
445.9758301	0.09
448.2185059	0.02
459.9896545	0.08
461.0891418	0.90
462.0432434	0.02
469.7599182	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	291.1001
Annotation	N-gamma-Glutamyl-S-allylcysteine
Peak:m/z	Relative Intensity
83.9527893	0.63
86.7166672	0.05
88.9440537	0.03
98.8538818	0.37
104.7913666	0.08
111.2351837	0.04
116.0271606	1.43
117.1517334	0.02
121.9823914	3.39
123.9209137	0.20
126.0635376	0.08
130.0232544	0.45
134.0878601	0.03
141.3527069	0.05
142.0995178	0.92
144.9245300	27.92
145.9242554	0.07
147.8432312	0.14
161.9763489	100.00
170.0058899	58.01
172.1200256	0.28
188.0147705	0.60
189.9517059	0.06
202.5582886	0.03
215.9014282	0.13
217.2879333	0.06
228.0213013	0.47
229.1665649	0.54
233.9958496	3.18
245.0371704	3.43
249.3014526	0.02
254.8850403	0.04
273.0270996	7.90
274.0440369	4.93
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	279.0002
Annotation	Unknow
Peak:m/z	Relative Intensity
90.9414444	0.24
107.2302246	0.08
108.9327087	0.19
116.9396133	0.12
128.8145142	0.17
131.0312500	0.15
134.8424377	0.06
143.0278931	3.25
146.9606781	0.06
150.0311279	0.18
150.9803314	0.36
160.9705048	0.08
168.0619659	0.11
172.9400787	43.83
173.9736938	100.00
175.0016174	0.04
192.0551147	0.10
193.4370422	0.07
195.2254944	0.04
197.2731628	0.32
201.1637878	0.36
205.1470642	0.13
207.0299072	0.13
209.3072510	0.11
218.7384033	0.06
233.1934509	0.04
234.8789978	0.13
237.2897949	0.38
244.9981079	0.80
247.0137939	0.08
258.9488831	0.09
260.2598267	0.32
261.0941772	1.40
261.9002075	0.08
263.2162170	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	380.0933
Annotation	2'-Carboxy-4-[bis(2-chloroethyl)amino]-2-methylazobenzene
Peak:m/z	Relative Intensity
108.1253586	0.01
113.8696747	0.04
116.0952454	0.06
122.0025253	0.05
129.9210358	1.10
130.9182129	0.07
133.0537415	0.03
147.2288971	0.12
147.9780426	0.25
151.9529114	0.01
155.8377686	0.01
160.2487793	0.03
166.9899597	0.02
168.0863647	0.11
168.9933472	0.01
170.1407776	0.22
175.9120789	0.86
177.0528259	1.79
185.2101440	0.02
187.4550018	0.11
188.0988922	3.15
193.3591309	0.04
199.9346161	0.14
209.1809387	0.04
211.0166626	0.23
215.9188538	0.32
217.1361542	0.20
230.9051819	0.07
233.3620605	1.28
234.1194458	1.76
234.7919006	0.02
241.7973633	0.02
250.9897766	100.00
251.5912476	0.26
259.2231750	0.01
276.2689819	0.06
277.2542725	0.14
287.0163269	0.56
305.0053101	8.22
305.9741821	0.04
315.5663757	0.03
316.9948425	0.39
323.2168579	0.03
334.3248291	0.05
335.0457153	0.04
361.1833191	0.07
362.1317444	1.96
363.0706787	0.58
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	624.2005
Annotation	kappa-Lactone
Peak:m/z	Relative Intensity
282.2065430	100.00
337.9921265	0.07
341.1599121	3.13
460.1500244	0.14
475.2949219	0.12
492.1539307	0.09
503.3626099	0.08
566.1193237	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	231.1334
Annotation	Hydroxyprolyl-Valine
Peak:m/z	Relative Intensity
69.9409180	0.32
115.9053040	100.00
117.0344238	0.03
118.2247467	0.03
157.8954315	0.04
165.2052155	0.04
174.9126892	0.02
187.3082886	0.01
212.9672852	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	357.25
Annotation	13,14-dihydro-15-keto Prostaglandin E1-d4
Peak:m/z	Relative Intensity
125.1664505	0.41
158.105835	0.22
159.2578583	0.91
161.8632355	0.21
163.0140381	1.51
169.0732117	0.34
173.1735687	0.45
187.0761108	1.77
188.875	0.72
199.1145782	0.70
203.1633911	1.24
205.0304565	0.89
211.9632568	0.81
213.3167419	1.21
214.9257507	1.27
223.9510498	1.03
227.3560791	1.55
229.3445435	1.89
230.7859192	0.98
243.2632141	1.42
257.183136	1.20
259.5574951	0.65
263.4292297	1.15
268.8673706	1.00
271.3106079	2.88
273.3044128	1.18
282.9839478	0.72
285.3372192	3.72
293.3234863	0.43
297.446167	2.31
299.0836792	3.19
302.3458557	0.32
310.4699097	0.33
311.2552185	1.27
311.9522705	0.32
313.1243286	3.91
314.0993958	1.04
315.2492371	0.43
321.3843384	2.01
323.3357544	11.33
325.4540405	1.13
328.2867432	0.30
339.2519531	100.00
339.862793	0.88
341.2668152	18.62
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3alpha,5beta,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
96.89003754	0.64
99.07362366	0.11
100.9313202	0.16
104.9794312	0.63
106.9133606	1.87
108.9904251	0.75
111.0240326	0.77
112.8716736	13.24
114.6883163	0.42
117.0147018	0.55
119.1533508	1.15
120.9981842	4.91
123.0870361	1.72
125.0869904	0.90
128.9288788	2.80
129.8964844	0.32
130.9470673	1.59
132.9528503	1.03
135.1310425	6.18
136.9605713	4.19
139.0982971	0.35
140.7127075	0.21
141.9261017	0.15
142.9320374	2.78
143.9497223	0.39
144.9824524	2.69
146.8578796	1.15
149.0379944	1.72
150.9199219	0.83
151.834137	0.25
152.9613495	0.63
154.1090698	0.37
154.7933655	0.16
157.0752563	1.75
158.8893433	2.45
160.0359802	0.57
160.9453125	2.19
163.0105286	1.53
164.9916382	2.36
167.0953674	1.52
169.0244751	3.18
170.9267273	1.25
173.0160217	1.73
174.9452362	1.05
176.9545746	2.31
177.9548035	0.17
179.0705109	0.59
183.05336	1.58
185.0750427	1.93
186.3732452	0.36
187.0670166	4.71
191.1467285	1.25
193.0327148	0.99
194.9576721	2.34
197.233017	0.68
201.23172	0.32
202.9286499	4.38
205.1505585	0.45
209.1043701	0.19
210.5993347	0.75
211.2329712	1.78
215.2111816	0.05
217.046875	2.03
217.924469	0.34
218.9447632	4.63
221.0706787	0.29
223.3821106	1.16
226.7923889	1.23
231.2337952	1.33
234.1736755	1.22
235.0521545	3.42
236.1085815	0.86
240.8006592	0.71
243.3811646	0.25
245.1392212	2.49
247.2910156	15.17
248.9585266	0.21
250.9455261	1.29
253.0675049	0.49
254.5040283	0.07
255.1123657	0.26
256.0128784	0.18
257.0767822	0.29
259.2616577	2.35
261.6108093	0.42
263.2473145	0.22
265.4393616	0.08
266.8629456	10.29
268.2631531	0.26
269.1026917	0.57
273.3918457	0.08
276.9568481	0.44
279.3842163	0.13
280.6270752	0.28
283.1606445	0.27
285.2852783	0.67
287.4011841	0.21
295.1658936	1.22
297.7589722	0.47
299.2244873	4.90
300.0884399	0.76
303.6326904	0.21
305.2104492	3.72
309.1459961	0.42
312.4216003	0.13
313.1603394	0.98
323.2289734	100.00
324.1838989	0.12
341.2901917	0.72
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1068.8623
Annotation	Unknow
Peak:m/z	Relative Intensity
300.3303223	0.07
303.3394165	0.13
304.3060303	0.08
312.2591858	0.17
313.4905701	0.07
315.5563965	0.18
317.1539307	0.05
333.4855347	0.08
335.1597595	1.30
336.2217712	0.41
339.3832397	0.11
344.2667236	0.41
354.3636475	0.08
355.1628723	0.12
364.3113403	0.13
367.2536621	0.03
371.4567261	0.10
372.4317017	0.16
374.3631897	0.05
375.7395020	0.48
376.3650513	0.10
377.2249146	0.22
384.4309082	0.11
385.1825256	0.12
388.1888428	0.16
389.3270874	1.32
390.4418945	0.15
391.1341553	0.10
392.0349121	0.02
396.2927856	0.07
397.6444702	0.13
398.3630066	0.10
399.3820496	0.27
400.2707520	0.02
403.2205200	0.05
406.0246887	0.32
408.4119568	0.07
417.1110840	3.58
418.0189209	0.90
419.3945312	0.23
420.2545776	0.22
421.0671387	0.10
425.2692261	0.07
427.9918823	0.03
430.2515259	0.03
434.1476746	2.24
435.4507141	0.23
436.9642334	0.26
438.5357056	0.04
439.3874512	0.68
440.3311768	0.26
443.1685791	0.24
444.3572693	0.11
448.1635742	0.20
452.0441895	0.08
455.5941772	0.04
457.2076416	0.20
458.3681030	0.11
460.2259521	0.28
461.5529785	0.59
462.5302124	0.12
463.5491943	0.07
466.3626709	0.18
467.5377808	0.10
471.1661377	1.01
472.4278564	0.03
473.0996704	0.10
474.5296326	0.33
475.2831726	0.17
476.2706299	0.12
480.2632446	0.12
482.2482910	0.04
485.2243652	0.46
486.2191772	0.39
488.2612915	0.41
489.2089233	0.19
494.2241211	0.04
498.4752808	0.17
500.1384277	0.03
502.3461609	2.38
503.3970947	0.70
504.1417236	0.15
504.7837524	0.11
505.3973999	0.12
506.3930664	0.06
512.2653809	0.13
516.6063843	0.37
517.5162354	0.48
519.4581909	0.41
520.4011230	0.25
523.3586426	0.09
526.3475342	0.31
529.2391357	1.00
530.2286987	6.11
531.3778687	2.41
532.2456055	0.71
533.4881592	0.14
535.2255859	0.14
543.4039307	0.04
544.5266113	0.04
547.2785645	3.25
548.2788086	1.31
551.6236572	0.04
553.7850342	0.15
555.6400146	0.22
556.5540771	0.47
557.4182129	0.47
558.4360352	0.07
559.5089111	0.22
560.4617920	0.08
561.0874023	0.17
567.3706665	1.13
568.6060181	0.26
569.5715332	0.06
570.4566650	0.07
572.2243652	0.05
573.7379150	0.07
575.6250000	0.16
577.6363525	0.12
579.5551758	0.06
584.0922852	0.77
585.6224365	0.84
586.6240845	0.04
588.2521362	0.09
589.3439941	0.06
589.9620361	0.06
598.4940186	0.12
599.2041016	0.27
600.5914307	0.18
601.2420654	1.22
602.4622192	1.01
603.4610596	0.12
608.7226562	0.06
611.5111694	1.22
612.5607300	0.30
613.1888428	0.03
615.3699951	0.16
616.4433594	0.38
617.2759399	0.05
618.3457031	0.54
619.3161621	0.26
627.2160645	0.08
629.2604370	13.22
630.3162842	5.49
631.4080811	1.29
633.5414429	0.11
641.2211914	0.08
643.1301270	1.62
644.3502197	0.32
646.3372803	8.60
647.4143066	3.12
648.3796387	0.53
653.1459351	0.19
657.5701904	0.18
658.4297485	0.19
660.1744995	0.45
661.5307617	0.24
668.5369263	0.11
669.4278564	0.22
670.6159668	0.02
682.6243896	0.29
683.7467041	0.68
686.2521973	0.03
687.1186523	0.63
697.0422363	0.69
697.6967773	0.07
699.3436279	0.16
704.1855469	0.05
707.7204590	0.25
715.0491943	6.92
715.9758911	2.48
716.9309082	0.10
724.6560669	0.31
725.4923096	0.10
729.4418945	0.03
731.3471680	0.23
732.0775146	0.21
740.6326904	0.48
742.3846436	18.41
743.3767090	10.63
744.3410034	2.06
748.5014648	0.12
758.4945679	0.77
759.3813477	4.43
760.5374146	2.51
761.6560059	0.21
762.4541016	0.02
770.3201904	0.05
772.1458740	0.15
774.4451904	0.08
775.5438232	0.03
777.6499023	0.06
783.5978394	0.32
785.4413452	0.04
788.0206909	0.33
791.3139648	0.05
796.4334717	4.40
797.1013184	8.67
797.9277344	2.17
802.5045166	0.06
807.8267822	0.11
810.3842773	0.30
821.8034668	0.07
836.2791748	0.02
838.4730225	0.03
844.8005371	0.33
853.3415527	9.32
854.2149658	5.16
855.0467529	0.24
856.2725830	0.08
857.9969482	0.48
859.9489746	0.08
862.6020508	0.40
869.7525635	0.21
870.5032959	5.64
871.4895020	3.91
872.5554199	0.95
882.7128906	0.02
887.5288086	6.83
888.4785156	2.56
889.7215576	0.87
890.6684570	0.28
893.7416992	0.07
897.9819336	0.31
898.9154053	0.04
902.8946533	5.94
903.7696533	1.16
905.8911133	0.15
917.7586670	0.08
919.3580322	0.24
925.2945557	1.51
926.6517334	0.07
927.8052979	0.18
929.9020996	0.18
934.7661133	0.27
937.5024414	0.11
939.4696045	0.05
940.4869385	0.46
944.1511230	0.11
951.2912598	0.17
952.5676270	1.82
953.9930420	0.55
957.9095459	1.51
958.5123291	0.04
960.1934814	0.22
961.5098877	0.13
966.4315186	0.04
969.1127930	0.03
970.6800537	0.05
982.3278809	0.04
983.2371826	0.55
988.4897461	0.43
989.6035156	0.03
993.6723633	0.07
998.3531494	0.34
999.6177979	2.41
1000.6166990	1.38
1001.5981450	0.56
1002.8151860	0.22
1004.7585450	0.09
1005.4436040	0.07
1006.8072510	0.17
1009.3891600	4.21
1010.3090820	2.15
1012.5996090	5.30
1013.7500000	0.39
1014.3962400	0.06
1016.4843750	5.47
1017.5169680	5.80
1018.4052730	1.68
1019.3975830	0.10
1020.4460450	0.64
1021.1783450	1.35
1023.5915530	0.23
1025.2824710	0.39
1025.9930420	0.19
1026.7148440	0.23
1028.9643550	0.13
1029.9721680	0.59
1031.6849370	0.10
1036.1268310	0.06
1037.2082520	0.06
1038.1293950	16.88
1039.0804440	3.18
1040.0905760	0.89
1040.7893070	0.47
1042.1400150	0.54
1044.0836180	0.20
1048.5009770	0.73
1049.5209960	0.38
1050.7849120	0.27
1051.8315430	1.40
1052.6250000	0.07
1054.4904790	0.61
1055.4450680	0.11
1057.0819090	1.37
1057.7480470	1.12
1058.5502930	0.22
1059.8127440	0.15
1086.8142090	0.58
1087.4730220	0.29
1095.2559810	8.50
1096.0235600	27.67
1097.2603760	0.34
1097.9555660	0.66
1098.6713870	0.49
1100.4816890	0.25
1103.1882320	0.19
1105.3791500	0.13
1107.1070560	0.07
1111.8231200	0.08
1113.2695310	0.33
1114.4578860	0.57
1115.7419430	0.27
1116.5195310	0.13
1120.6975100	0.16
1131.4821780	3.38
1132.6245120	2.87
1133.9208980	0.39
1138.5708010	0.05
1139.2312010	0.08
1140.7160640	0.18
1150.4980470	1.38
1151.3640140	5.56
1152.2359620	0.40
1153.1409910	0.12
1153.9504390	0.34
1154.9376220	0.16
1160.0003660	33.28
1160.7999270	26.97
1161.7454830	1.56
1162.3696290	1.36
1163.2851560	0.48
1163.9996340	0.15
1164.7412110	0.28
1165.4174800	0.11
1166.5748290	0.05
1168.7229000	0.89
1170.0517580	1.12
1171.0898440	0.19
1172.0163570	0.74
1172.7614750	0.11
1174.5615230	0.11
1176.6933590	0.05
1181.2661130	0.11
1182.4897460	0.05
1188.0740970	0.34
1188.7452390	1.07
1189.5950930	1.32
1190.3778080	0.62
1198.7844240	0.17
1206.3507080	3.54
1207.2014160	1.10
1207.9755860	0.12
1208.6241460	0.07
1213.6573490	0.06
1215.0134280	7.66
1215.8430180	24.17
1216.8597410	2.29
1218.1530760	1.06
1219.3925780	0.24
1220.6510010	0.11
1224.0933840	49.51
1224.7766110	24.01
1225.4445800	4.20
1226.3686520	1.08
1227.1413570	0.48
1228.4379880	0.08
1229.2541500	0.07
1230.1201170	0.10
1233.5173340	0.05
1235.2874760	0.06
1237.4815670	0.18
1239.6701660	0.24
1244.1247560	0.25
1245.1955570	0.30
1247.3635250	0.09
1248.2487790	0.06
1253.6861570	0.61
1254.4993900	0.22
1258.3555910	0.18
1259.7934570	0.08
1263.0601810	3.23
1263.9106450	3.80
1264.7751460	0.13
1265.4011230	0.27
1266.3898930	0.17
1269.4050290	0.16
1271.5412600	3.48
1272.4510500	2.63
1273.2152100	0.78
1274.2156980	0.09
1275.0820310	0.25
1277.3933110	0.07
1280.8868410	100.00
1281.8218990	18.89
1283.2257080	1.24
1284.1724850	0.27
1285.4628910	0.46
1286.1208500	0.43
1287.0305180	0.10
1287.7644040	0.12
1288.5479740	0.07
1290.1674800	0.06
1291.6740720	0.09
1292.9394530	0.32
1301.1665040	0.33
1302.4241940	0.47
1303.8583980	0.24
1304.8861080	0.22
1305.7899170	0.10
1311.6754150	0.36
1312.5172120	0.05
1313.1896970	0.04
1321.2612300	2.32
1322.0673830	4.33
1323.0452880	0.27
1325.8409420	0.21
1330.2142330	30.80
1330.9119870	19.68
1331.9549560	0.60
1332.6097410	0.49
1333.4320070	0.39
1334.3592530	0.03
1335.2119140	0.42
1336.0144040	0.16
1337.3751220	0.05
1338.5632320	0.14
1343.8916020	0.12
1348.2113040	0.11
1352.3468020	0.05
1354.5677490	0.02
1357.4393310	0.38
1358.1850590	0.05
1362.5142820	0.04
1369.1755370	0.12
1369.9727780	0.09
1370.8123780	0.07
1373.2432860	0.34
1377.5283200	0.52
1378.5728760	3.25
1379.6091310	0.43
1381.6173100	0.06
1383.9064940	0.10
1384.8209230	0.23
1386.6483150	21.02
1387.4342040	27.12
1388.7813720	0.73
1389.4365230	0.23
1390.4820560	0.41
1392.1011960	0.21
1400.0347900	0.03
1401.6125490	1.14
1402.6314700	1.02
1403.7674560	0.88
1404.5814210	0.18
1409.8902590	0.26
1410.6324460	0.08
1411.6302490	0.15
1413.7637940	0.06
1419.7224120	0.08
1424.3521730	0.11
1427.8144530	0.27
1428.8709720	0.05
1429.5155030	0.19
1430.1870120	0.18
1431.7344970	0.22
1433.8970950	0.08
1436.1542970	3.27
1436.8331300	4.77
1437.6922610	0.09
1443.6856690	0.12
1448.7188720	0.03
1455.5629880	0.19
1456.6689450	0.06
1463.9097900	0.05
1465.0999760	0.10
1466.9389650	0.12
1481.7467040	0.08
1482.7868650	0.17
1483.7996830	0.84
1484.6031490	0.65
1488.8812260	0.10
1490.8367920	0.19
1497.7288820	0.14
1500.7574460	2.19
1501.6234130	2.11
1502.5405270	1.29
1503.5356450	0.16
1505.5250240	0.06
1507.3220210	0.08
1509.9578860	0.15
1518.1306150	0.59
1530.8269040	0.85
1532.3072510	0.06
1540.5069580	0.02
1549.1905520	0.12
1557.1075440	0.10
1558.6765140	0.15
1560.1046140	0.03
1568.5054930	0.18
1573.6114500	0.11
1576.5018310	0.20
1577.5457760	0.20
1578.2919920	0.16
1579.7879640	0.53
1587.9697270	0.43
1591.8681640	0.58
1592.9178470	0.48
1594.1007080	0.29
1594.8361820	0.15
1596.6137700	0.76
1597.8021240	0.62
1598.6469730	0.15
1605.6446530	0.07
1609.0252690	0.10
1613.6325680	3.09
1614.8433840	2.83
1616.0325930	1.16
1616.8488770	0.15
1623.6722410	0.13
1629.7729490	0.10
1662.3492430	0.03
1663.6057130	0.05
1664.7214360	0.15
1676.9543460	0.09
1686.8538820	0.18
1689.0876460	0.04
1689.7845460	0.19
1691.5118410	0.22
1704.6022950	0.13
1705.2667240	0.19
1706.0729980	0.62
1707.4222410	0.09
1742.7717290	0.15
1744.4968260	0.16
1752.0179440	0.13
1752.9305420	0.31
1757.7755130	0.03
1759.5704350	0.43
1760.8602290	0.27
1764.1809080	0.04
1771.8450930	0.07
1774.7191160	0.07
1776.8824460	0.57
1777.9522710	0.88
1779.0305180	0.43
1780.2156980	0.12
1787.9993900	0.06
1804.6361080	0.65
1806.3109130	0.06
1811.0900880	0.07
1812.7950440	0.12
1834.0867920	0.19
1835.4451900	0.07
1845.7316890	0.04
1857.0235600	0.04
1864.9323730	0.13
1872.1265870	0.24
1880.0821530	0.17
1888.9056400	0.29
1902.4675290	0.07
1904.2370610	0.17
1906.0477290	0.08
1922.0250240	0.44
1922.6446530	0.18
1938.0177000	0.24
1940.4284670	0.04
1966.1096190	0.11
1970.8321530	0.08
1992.5500490	0.06
1993.7813720	0.13
1994.7999270	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	342.3
Annotation	C-2 Ceramide
Peak:m/z	Relative Intensity
97.8921051	0.55
98.9617157	0.41
106.9646301	0.41
109.1769714	1.89
122.1069489	0.38
122.9935684	0.93
130.903717	0.79
135.3357086	0.42
135.9449463	2.19
147.1278076	0.98
148.9627228	1.97
150.105835	0.35
152.9304504	2.11
155.0549927	0.85
156.3014526	1.01
158.9818726	1.15
159.9714355	1.16
160.8020935	0.47
162.1652222	0.77
169.0835419	0.63
172.1123047	0.79
174.5964966	0.55
177.991684	0.65
183.9159241	2.45
184.9374237	0.58
188.0149384	0.33
189.1077576	0.51
193.1311798	0.29
196.0540009	0.59
199.0343628	0.92
200.206665	0.71
202.3267517	0.24
203.3095398	0.52
204.5329742	1.36
205.3440704	2.47
211.9749451	1.79
218.186615	0.75
224.9396057	1.21
227.9988708	1.28
232.1199951	2.86
234.1158752	1.12
235.9254456	1.78
237.4522095	2.20
244.4030762	1.46
245.4302368	1.76
247.4190979	1.08
248.5653687	1.21
250.3750916	0.27
251.4177856	2.93
252.3692932	0.48
254.2186584	3.78
255.5320129	1.22
259.097229	0.66
261.2226868	0.63
265.0688171	1.43
265.7587891	4.04
268.3346863	0.59
269.8945007	0.67
271.1792603	0.69
275.0224304	1.37
276.4862671	0.43
278.300354	1.88
280.2597656	17.56
283.2650146	0.36
284.4249878	0.63
285.2299194	3.19
288.7702942	0.82
293.2371826	8.29
296.1648254	5.62
297.0026245	0.96
298.2602539	63.22
298.8948975	1.07
300.2461548	1.20
301.0280151	1.35
306.1746216	8.64
307.1850586	1.96
309.7938843	1.09
311.1557617	0.43
313.2333984	1.14
314.2769165	1.40
324.2840576	100.00
325.1062012	8.60
333.480957	0.59
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	842.2605
Annotation	Unknow
Peak:m/z	Relative Intensity
250.5682220	0.03
311.2064819	0.01
341.0779114	0.15
383.2785034	0.13
485.1527710	0.08
503.1078491	0.15
503.7161865	0.01
665.2680054	100.00
666.2992554	1.53
667.6038208	0.00
668.4811401	0.01
680.9197388	0.02
720.5619507	0.06
734.2940674	0.02
784.0869141	0.50
785.1548462	0.07
800.6235962	0.06
801.2506104	4.11
802.2085571	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	295.128
Annotation	L-gamma-Glutamyl-beta-phenyl-beta-L-alanine
Peak:m/z	Relative Intensity
84.0153656	0.02
91.1244659	0.04
103.0703278	0.19
119.9389267	17.88
130.0190582	0.06
130.9847107	0.26
148.2487335	0.24
148.9289551	0.73
165.9854736	100.00
186.2362366	0.12
232.0821228	0.96
249.0958557	0.21
259.0991211	0.34
277.0978088	2.05
278.0930176	7.39
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	502.1604
Annotation	Antibiotic K 252d
Peak:m/z	Relative Intensity
142.9346008	0.06
149.1657104	0.08
158.9647522	0.19
160.0478210	0.70
161.1368408	0.12
178.8858948	1.60
209.1479187	0.07
303.3578796	0.02
330.2281189	0.03
341.2387695	100.00
342.7829285	0.03
366.2177124	0.02
371.2569580	0.22
380.1348267	0.04
386.3603821	0.06
439.1210632	0.04
456.1677551	0.11
458.2842712	0.02
483.1580200	0.29
END