#DEFINITION	Reference Metabolome for Allium cepa
#IDENTTFIER	RefMeta-Allium cepa.R1
#FORMAT	msr
#VERSION	1.0/R1
#KEYWORDS	RefMeta
#ORGANISM	Allium cepa
#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 cepa 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	863.2446
Annotation	Unknow
Peak:m/z	Relative Intensity
323.0162354	0.01
341.2492065	0.15
383.3754883	0.26
384.2137451	0.01
412.7302856	0.02
425.0394897	0.01
443.1397095	0.06
485.5621948	0.19
503.0377808	0.07
539.2759399	0.07
545.6999512	0.06
546.6825562	0.01
647.3476562	0.06
665.3989258	0.17
683.3490601	0.09
701.1781616	0.15
707.4622192	0.18
827.3795166	100.00
828.3690186	14.01
829.0330811	0.08
872.8877563	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	660.1002
Annotation	Unknow
Peak:m/z	Relative Intensity
202.1054993	1.02
209.0041351	0.48
215.0541382	0.31
219.1515045	7.98
226.9916840	0.19
251.2719116	0.47
255.1286926	1.29
287.1752625	0.20
291.3299255	0.86
300.0815430	0.73
308.1185303	0.47
312.4805908	0.49
317.1140137	1.62
325.7864380	0.94
335.0195312	0.29
348.1710205	3.58
352.7731934	0.33
382.1367798	0.11
393.2121582	0.18
415.1450806	0.65
427.5373535	0.57
428.2069092	5.27
439.2180786	0.93
486.5167236	0.34
505.2407227	0.16
511.3605957	1.17
513.0888062	0.29
516.2687988	0.23
531.1834106	100.00
536.4915771	0.61
554.5311890	0.76
570.2028198	0.25
584.6761475	1.16
585.2852783	12.75
595.1380615	0.38
613.7128296	0.25
615.6345215	1.18
638.3369751	0.34
642.4619751	2.11
650.8096313	0.36
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	516.8976
Annotation	Unknow
Peak:m/z	Relative Intensity
159.0063477	0.57
174.9265594	0.31
198.7911987	0.09
229.0356598	0.11
244.9576111	0.06
273.0880737	6.52
287.0286255	0.07
289.0372314	9.86
386.0924072	0.23
387.1497803	0.80
401.0737915	0.29
402.9521484	100.00
429.1024170	0.03
443.1472778	0.17
454.9066772	0.11
460.2116699	0.03
468.8268433	0.05
471.8877563	0.07
489.1557007	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	581.1924
Annotation	N-gamma-Glutamyl-S-allylcysteine
Peak:m/z	Relative Intensity
170.0046539	0.46
187.9901733	0.22
205.5062866	0.06
272.1882324	0.08
273.1970520	0.76
274.0787048	0.57
291.1089478	100.00
291.8078613	0.09
297.1748047	0.16
314.0943604	0.08
349.5826416	0.08
359.9168091	0.26
376.2644653	0.84
427.0623779	0.19
439.3299561	0.25
475.3311768	0.24
506.0460815	0.18
507.2563477	0.16
534.4372559	0.23
540.4421997	0.15
561.0308228	0.22
562.6256714	0.37
563.4612427	0.24
572.5989380	0.41
580.5759888	0.19
582.2499390	0.46
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0852
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
81.89242554	0.26
94.90782166	0.09
102.8529663	0.51
103.8898773	0.09
104.782547	0.10
107.0123444	0.26
109.9101868	0.08
111.3297729	0.18
118.8768158	0.11
121.1988525	0.13
122.9671478	0.15
125.995163	0.07
129.0218964	2.08
130.0836334	0.54
135.1446838	0.38
141.6407928	0.14
143.8535767	0.32
151.0462646	12.13
151.9249725	7.68
153.0337067	0.45
157.2058868	0.09
160.2594452	0.36
165.7933044	0.46
167.2937012	0.52
167.9004059	0.10
169.0895996	0.87
177.2782135	0.25
179.0502167	0.14
179.9321747	0.29
183.7866058	0.16
185.2788086	0.34
187.8063507	0.23
190.1033936	0.16
194.2069702	0.10
196.0388336	0.12
196.7848053	0.26
198.2084808	0.13
206.1508331	1.64
207.1159668	0.28
208.1297302	1.22
210.3871002	0.18
211.1364288	0.46
211.9054413	0.18
217.1045074	0.10
218.1169281	0.93
225.1127472	1.21
226.0830231	2.28
236.0866852	2.72
237.9574127	2.25
239.1870117	1.37
240.2023163	0.11
245.0839691	0.14
251.1470337	0.71
253.0924683	100.00
254.224472	10.45
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	547.094
Annotation	Unknow
Peak:m/z	Relative Intensity
202.4580231	0.11
265.2344971	0.08
277.0559692	0.84
289.0508118	0.18
294.7098389	0.23
296.5509033	0.25
303.6610718	0.26
305.0323486	0.43
306.9071045	2.44
310.5223999	0.10
317.6282959	0.22
324.3032837	0.19
325.0767212	0.68
331.0283813	0.09
337.0804443	1.68
365.2242432	0.95
366.1805420	0.45
367.1473999	1.25
374.7078857	0.26
383.3629150	0.47
384.1946411	3.25
385.1867676	2.30
395.2315674	0.14
396.9719238	51.62
397.6685791	0.44
420.9882202	0.27
439.2631226	0.07
441.3247681	0.11
447.6185913	0.15
456.1397705	0.25
457.0708618	0.24
465.5529785	0.57
469.1277466	0.21
471.4465942	1.24
472.1910400	0.75
528.9248657	100.00
529.6583862	0.63
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	452.0985
Annotation	Unknow
Peak:m/z	Relative Intensity
128.0732117	0.75
143.1027222	2.20
146.1376953	0.95
152.9945374	0.38
155.8780518	0.03
156.9797974	0.17
159.9886780	0.50
167.1663208	0.33
168.9559937	3.27
171.0413513	0.11
175.0745239	0.08
179.1349182	3.28
181.1741333	0.36
185.0233459	0.51
192.3039551	0.11
197.0729980	0.76
203.1209869	5.73
210.2805176	2.31
213.2933655	0.06
215.0158081	1.05
221.8585815	0.08
231.1327667	4.77
236.1101685	0.50
237.9329834	0.15
249.2420044	4.84
252.2602234	0.05
254.1915894	15.01
270.0651855	0.72
272.1813660	59.87
285.3101501	0.61
286.0906982	0.34
288.2202148	7.40
292.2021179	0.10
296.0637512	0.23
302.0402832	0.07
302.8264771	0.14
304.0996094	0.45
306.2642822	24.59
322.4339905	0.14
323.1654663	0.12
326.1256409	0.46
335.0927734	0.06
344.2805786	0.12
346.2815552	0.12
360.1303711	13.50
361.8359070	0.08
378.2305298	100.00
384.3873901	0.14
398.1864319	0.05
408.2276306	0.05
414.4264832	0.28
415.2019348	0.05
416.2479248	0.14
434.1973572	9.68
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	385.1139
Annotation	3'-O-beta-Glucopyranosyl plumbagic acid
Peak:m/z	Relative Intensity
113.0071564	0.06
138.7160034	0.04
143.0912323	0.12
148.9329834	0.11
163.0349426	0.03
164.0590515	0.47
173.1556091	0.18
179.2001495	0.70
187.1184540	0.13
203.2621155	0.03
205.0070801	0.15
207.0895691	0.04
208.1090546	2.05
209.0157776	0.12
223.1723022	100.00
241.3048401	0.05
245.2302551	0.12
247.1970520	1.04
251.1124878	0.11
255.1161194	0.08
265.1510315	1.30
269.3002625	0.04
277.0545654	0.03
289.3566589	0.05
291.1360474	0.12
295.0317383	0.12
301.3682556	0.10
309.0501709	0.04
312.0259094	0.03
313.1444702	0.12
317.0663452	0.08
323.4487610	0.08
324.9136353	0.08
329.3565063	0.02
337.2227783	0.05
339.1854248	0.68
340.4435120	0.15
341.2371216	0.33
343.2484436	0.11
347.2643738	0.27
355.4081116	0.24
356.0649414	0.03
357.1846008	0.15
363.6726074	0.12
365.2199402	0.06
367.1702576	0.97
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1353.3932
Annotation	Unknow
Peak:m/z	Relative Intensity
381.1602478	0.03
525.3684692	2.19
526.3077393	0.24
543.2775879	2.64
544.1872559	0.42
645.4347534	0.05
687.4053955	8.45
688.4062500	1.26
705.3872681	10.15
706.3490601	1.94
849.4671631	12.28
850.5663452	1.73
867.4514160	30.68
868.4824219	5.82
969.2967529	0.21
970.6577148	0.13
1011.4444580	9.10
1012.5173340	3.12
1029.4945070	80.27
1030.4992680	21.25
1031.1386720	0.45
1101.6812740	0.07
1132.5122070	0.06
1173.5491940	12.04
1174.6044920	2.78
1191.5153810	100.00
1192.5322270	34.66
1193.1838380	0.30
1263.6213380	0.11
1335.1798100	0.06
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
119.9644470	100.00
120.9486389	0.01
130.8862457	0.37
137.8514862	0.01
147.8630066	0.86
148.9782257	7.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	534.05
Annotation	Unknow
Peak:m/z	Relative Intensity
162.0781860	0.56
170.0021057	0.33
179.0874634	2.03
202.0899200	0.78
208.9931183	0.53
219.0514984	3.89
231.9640808	0.77
273.1219482	1.51
286.1642761	0.24
289.7958984	0.16
293.8675537	0.19
306.5185547	0.87
307.1290283	4.02
308.1894531	1.63
313.0160522	0.17
330.2848511	1.81
339.2237549	0.61
348.2423706	100.00
386.8817749	0.78
389.0467529	0.57
397.0248413	65.98
397.6722412	0.34
404.0749512	5.24
404.9879150	4.00
414.5299072	0.34
427.7474365	0.38
444.9794922	0.38
456.9508057	0.13
458.7623901	0.19
460.9903564	0.24
474.3498535	0.20
484.6155396	0.39
487.4398804	0.60
488.3289185	0.25
501.9005127	0.28
504.4304199	1.14
516.1019287	78.28
525.0031128	0.44
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	325.04
Annotation	UMP
Peak:m/z	Relative Intensity
92.0307312	0.11
93.0774002	0.20
94.8420410	0.41
96.0051498	0.15
97.1064301	0.31
104.7762756	0.25
106.9060516	0.34
109.1122055	0.57
109.7845306	0.09
110.9730072	0.23
113.1910095	0.16
113.9143219	0.06
119.2005463	0.31
121.0403290	1.80
122.1337280	0.18
123.0041122	1.52
124.0774689	0.13
125.2372742	0.04
126.8379669	0.09
129.0311737	0.97
130.9561768	0.90
133.1044617	0.74
133.8789368	0.15
135.0721588	1.70
136.2870026	0.04
137.3947449	0.29
138.1703491	0.21
139.0565796	0.13
140.0294647	0.45
141.0757751	0.40
144.9359741	0.93
146.2040710	0.03
147.0081177	0.41
149.0729065	1.14
150.5948792	0.54
151.2834778	0.43
152.4738770	0.13
153.0770874	0.07
153.7647095	0.17
156.0863037	0.10
159.1286926	0.33
161.0691986	1.16
163.1322632	0.96
165.2580261	0.34
166.0478821	0.47
166.9134064	0.23
169.0621948	0.81
170.3324280	0.15
173.1121826	0.55
175.1207886	0.40
176.5768433	0.36
177.2492676	1.03
178.2273865	0.09
179.1218567	0.91
180.0588684	0.30
182.3031616	0.05
183.0317078	0.30
184.0572968	0.36
187.2229614	0.43
189.3403168	0.28
191.0848694	0.26
192.6235046	1.04
193.2906036	2.59
194.0073547	0.16
194.8785248	0.23
197.0071106	0.08
198.2845917	0.61
201.1757202	0.90
202.2023010	0.20
203.2041626	0.12
205.3322144	0.59
206.2436218	0.11
207.1749878	1.37
209.2073975	0.07
210.2302856	0.27
212.1272278	2.59
213.0737000	0.21
215.2808533	0.21
216.3291321	0.20
217.0766907	0.19
221.2478943	0.04
224.3144531	0.24
226.0794983	0.06
228.5923462	0.06
229.3161926	0.11
231.2050476	0.16
233.3384094	1.31
235.0755310	3.70
238.2714844	0.05
239.4129944	0.24
240.2989807	0.31
242.1863708	0.08
243.3331604	0.12
245.2052307	0.91
247.2582397	8.74
248.3102417	0.38
249.3209839	0.16
250.3819580	0.35
251.3450623	1.11
252.1618958	0.45
253.2391968	0.62
258.2226562	0.16
259.2764587	1.59
261.3459473	2.91
262.7288513	0.71
263.3930054	3.55
264.3935242	0.33
265.1331787	2.72
268.1605225	67.41
269.1815796	11.03
271.3239746	5.84
272.3653564	0.27
273.3856506	0.09
275.7070312	0.25
276.3927307	0.97
277.3787842	3.51
278.3636169	0.99
279.9492798	0.35
280.9395142	0.17
282.2164307	0.51
288.5599670	3.71
289.2601318	54.89
290.3222961	1.63
294.2313232	6.92
295.3655396	2.35
296.4204102	1.09
297.4824524	0.36
306.3141174	100.00
307.2855225	12.76
308.3098145	1.10
315.3377075	0.48
324.3284302	0.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	550.17
Annotation	Unknow
Peak:m/z	Relative Intensity
179.1123047	0.01
196.1288757	0.03
241.8831787	0.03
272.4498901	0.01
299.5625305	0.01
312.1632690	0.02
321.8342285	0.04
323.2395630	0.01
341.3572388	0.01
342.0415649	0.02
387.3828125	0.01
392.3223877	0.03
402.6303101	0.05
420.1252441	0.03
429.4870605	0.01
430.2194824	0.02
446.1871948	0.03
458.1022339	0.03
460.3093262	0.01
463.7262573	0.01
503.2872925	100.00
504.3947144	6.86
506.3093872	0.07
531.3400269	0.18
532.2843018	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	281.1
Annotation	N-Despyridinyl rosiglitazone
Peak:m/z	Relative Intensity
87.9682465	0.11
101.9706955	0.59
103.9965668	1.88
105.0484314	0.78
106.0066528	5.37
106.8542328	0.15
120.0042953	0.19
129.9161072	0.26
132.9567413	3.43
133.8627625	2.09
135.0303802	16.62
136.1883240	0.11
147.9309387	0.59
150.0122070	31.15
151.0134735	25.76
152.0264130	100.00
158.1021271	0.09
204.8885498	0.06
212.4390564	0.10
216.3042908	0.36
218.0382996	2.50
219.2765808	0.08
222.5272217	0.53
233.1010132	0.06
234.1408997	0.49
235.0580139	0.38
236.0020142	0.12
239.2866211	0.22
245.0875854	0.06
250.1589661	0.23
252.2199402	0.07
263.1253967	6.18
264.1945801	10.20
265.1707153	0.15
271.6926270	0.11
280.2630615	0.05
288.2160339	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	385.114
Annotation	3'-O-beta-Glucopyranosyl plumbagic acid
Peak:m/z	Relative Intensity
110.8263245	0.05
112.9591980	0.21
120.9427643	0.11
147.0794067	0.35
149.0261536	0.67
161.0007019	0.23
163.5489197	0.14
164.1496277	4.31
170.2972870	0.03
179.1132965	1.01
190.1017761	5.22
203.3031921	0.13
205.1036987	49.76
206.0379639	0.06
208.1376495	1.03
209.2697144	0.17
221.1764832	1.44
223.1480103	100.00
232.0909119	0.46
233.2340088	0.45
237.1169739	0.21
247.1477661	57.08
249.1624451	0.15
251.3870850	0.19
261.0301208	0.09
263.2871094	0.22
265.1634521	8.95
273.9558105	0.18
277.1204834	2.32
287.2204590	0.16
289.1058960	1.48
293.8280334	0.11
295.2100525	4.63
305.3159180	0.21
307.1487122	0.19
308.2519531	0.06
325.2608032	4.25
339.2749939	0.10
340.8987427	0.06
346.3873901	0.20
348.2743530	0.39
357.6461487	0.06
364.8171082	0.20
367.3387146	1.98
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	556.17
Annotation	Unknow
Peak:m/z	Relative Intensity
149.1327667	0.10
167.1671448	0.13
178.1070099	0.12
179.0431519	0.36
179.9717102	0.56
185.7211456	0.10
200.0161438	0.51
201.1398010	0.37
208.1569977	0.10
209.2201843	0.16
210.2788086	0.31
211.1815338	0.19
214.2165070	0.10
217.1593170	0.37
227.1081543	0.15
228.3019104	0.07
245.1600952	0.06
249.3230896	0.04
253.6027832	0.37
254.2415619	5.36
255.2601013	3.55
256.1669922	1.18
261.4754028	0.24
262.2395325	0.10
263.1641846	0.42
264.1396484	0.60
265.1287842	0.21
269.2438965	0.08
272.1480103	7.86
273.1718750	4.42
274.2100220	0.94
276.7835693	0.17
288.1766357	0.09
290.3493347	0.32
291.2471313	0.95
292.2926025	0.05
294.2564697	0.06
295.2460022	0.06
297.2196655	0.64
298.3438110	0.10
300.4634399	0.05
306.1753540	2.10
307.1761169	3.99
308.1699524	1.50
312.6384888	0.17
314.4876709	0.27
318.2703247	0.29
319.3871460	0.06
320.3078613	0.10
324.2813721	0.78
324.9713745	0.23
325.7723389	0.77
326.4910889	0.17
327.2602539	0.63
328.4244385	0.12
335.3464355	0.33
336.2238770	0.55
337.1964722	0.38
338.3963623	0.10
340.3835449	0.05
343.3119507	0.11
344.1796265	0.41
345.4600830	0.36
346.4631958	0.05
348.3527222	0.09
349.6766357	0.05
354.2420044	1.76
355.3297119	2.56
356.3710938	0.10
357.1210938	0.11
358.3858032	0.10
359.2536621	0.27
361.0269775	0.31
361.8946533	0.10
371.3602905	0.42
372.3637085	1.09
373.3216553	2.16
374.4421997	1.61
375.3009644	1.80
376.3113403	1.14
377.4426270	0.09
379.4684448	0.13
380.2009277	0.64
388.1536255	0.09
389.1497192	0.72
390.3469238	0.75
392.2392578	45.04
393.2324219	100.00
394.2000732	42.29
398.7100220	0.27
399.3854980	0.25
403.6328735	0.05
406.0857544	0.09
407.3171387	0.37
408.2557983	0.22
414.2221069	0.14
415.2278442	0.06
416.3565674	1.36
417.3789673	3.47
418.1282959	0.06
421.4157104	0.34
422.0343018	0.17
432.2677612	0.40
433.2607422	0.97
434.3093262	2.87
435.2952881	6.22
436.2703247	1.47
445.1958618	3.34
446.2524414	1.58
447.3275146	1.03
448.3032837	1.08
451.2941284	0.09
451.9234009	0.39
454.3043213	0.06
456.6131592	0.41
457.4000244	1.50
458.1600342	0.41
460.3139038	0.06
462.2698975	0.09
463.3093872	1.36
464.2832642	4.19
465.2379761	16.03
466.3511353	7.72
469.3464355	1.52
470.4311523	0.37
471.2753906	0.07
474.5953979	0.96
475.4219971	3.66
476.4030762	0.41
477.3947144	0.37
478.3284302	0.29
484.2753296	0.07
492.3833618	1.69
493.3175659	10.57
494.2927246	4.44
495.2990112	2.47
496.3694458	0.80
507.0927124	0.13
510.8000488	0.64
511.4334106	4.05
512.3876343	1.50
519.2538452	0.36
520.2800903	0.19
536.5316772	0.51
537.2647705	10.14
538.3595581	5.58
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	274.96
Annotation	Unknow
Peak:m/z	Relative Intensity
115.0079193	5.16
116.1198730	2.70
116.9635315	2.52
130.9904480	0.29
131.8975372	0.08
133.0451813	0.30
158.9888306	100.00
160.0040741	47.96
160.9533081	63.14
161.6768341	0.01
173.3012848	0.04
185.7704926	0.02
198.9938049	0.13
200.0133362	1.39
201.0490417	2.10
217.8868408	1.06
219.0726318	1.69
228.9211121	1.98
230.0281982	21.35
230.9495544	32.38
245.5855408	0.27
246.1918640	0.37
247.0883179	0.86
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	532.8751
Annotation	Unknow
Peak:m/z	Relative Intensity
158.8677521	0.16
174.9548340	0.92
199.0897522	0.07
213.0406952	0.02
215.0016479	0.05
217.4113159	0.04
229.2683563	0.03
245.1290283	0.31
260.9044189	0.02
273.1320801	1.68
274.1307983	0.03
289.0084839	13.47
304.9926147	4.24
313.0465088	0.09
387.0837402	2.54
388.1440430	0.18
389.1121216	0.03
402.9966431	8.60
417.1361694	0.13
418.9535522	100.00
419.5957031	0.16
446.2821045	0.02
458.0980835	0.11
459.0788574	0.22
461.0750122	0.02
477.2212524	0.03
486.0839844	0.17
486.9357300	0.62
495.3087158	0.11
499.3035278	0.04
505.0219116	0.30
505.6951294	0.03
515.1907349	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	322.2732
Annotation	Oleoyl glycine
Peak:m/z	Relative Intensity
90.9225693	0.16
92.9881897	0.19
94.9206238	1.24
97.2442169	0.20
98.1163177	0.17
99.1046600	0.08
104.9350281	0.51
107.1144485	0.82
108.9389496	1.19
109.9507751	0.06
111.1086655	1.27
112.1049500	0.12
113.0873718	0.24
114.1159210	0.06
115.1189499	0.06
119.0676727	0.64
121.0592804	2.75
123.0977020	1.56
125.0233612	0.28
127.3186798	0.05
127.9648895	0.05
128.9912109	0.47
129.9179993	0.33
131.1202545	1.63
133.1716156	2.47
134.0133820	0.03
135.1114197	4.69
137.1303101	1.91
138.2063293	0.14
139.0428162	0.13
140.1848145	0.86
141.0524597	0.18
143.1305847	0.08
145.1133575	1.16
146.0871277	0.07
147.0966797	1.45
149.0444031	2.45
150.0552063	0.13
151.1349792	2.63
152.0383606	0.15
153.1459961	0.23
154.0279236	0.74
155.2617188	0.22
156.3215942	0.34
157.1417847	0.37
159.1577759	1.08
161.1700134	2.30
163.0993652	5.26
164.5013580	0.13
165.1719513	1.31
166.0830231	0.64
167.2246857	0.19
168.1210632	0.05
170.2243042	0.44
171.1446686	1.84
172.2212219	0.19
173.1536713	2.71
175.1054688	4.10
177.1663208	2.53
178.1475067	0.46
179.6268005	0.88
182.0711365	0.06
185.2664795	2.31
187.2226562	3.71
189.2436981	2.82
191.0969543	2.04
192.2601929	0.54
193.1785583	0.31
194.1146851	0.17
195.0041962	0.20
196.2637634	0.42
198.0216217	0.26
199.2392120	2.96
201.1321411	1.90
202.1385193	0.16
203.0879517	0.34
205.1294861	5.30
208.0879211	0.75
210.2761230	0.05
213.1723938	1.37
215.2257690	0.68
217.3145752	1.20
218.4210205	0.58
219.3158264	1.88
220.2922363	0.16
221.0529175	0.21
222.4098816	0.20
223.1710815	0.11
224.4178772	0.55
226.2682495	0.22
227.2035217	1.66
231.2903137	2.26
233.1698914	3.31
233.8559265	0.13
235.1444702	0.28
236.4204102	0.07
238.3112488	0.18
239.9786377	1.01
241.1400452	0.89
243.2503967	2.21
245.3164978	15.62
247.3483276	0.58
248.9999390	1.10
251.3012085	0.96
252.3872375	0.12
253.2643433	0.10
257.3413696	2.74
258.6043091	0.46
259.2776794	5.12
260.1411743	0.33
261.3085327	5.77
262.1869507	0.12
263.3081055	4.44
265.0336304	0.42
266.3038940	0.92
269.2564087	17.15
272.9675598	0.18
274.5481567	1.46
275.2536621	7.97
276.4494019	1.32
277.4132080	0.54
278.3247681	0.63
279.2244873	0.71
281.1097107	0.35
283.3925781	0.38
284.2559204	0.34
285.3393250	1.41
286.3549500	8.13
287.3126831	57.17
287.9301147	0.25
292.4871216	3.93
294.1627197	2.12
301.3140869	1.64
303.3168640	8.05
304.3317566	100.00
305.3399963	4.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	518.16
Annotation	Unknow
Peak:m/z	Relative Intensity
161.1092224	0.26
176.0562744	33.40
179.0472717	2.26
221.2756042	0.05
250.9346008	0.12
280.7806091	0.13
321.3245850	0.05
338.3645020	0.05
339.2056885	0.03
341.1771851	100.00
356.0350952	0.27
371.2836304	0.05
427.9924316	0.31
455.9864502	0.21
498.3621826	0.03
500.2095947	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	519.267
Annotation	Leucyl-Glutamate
Peak:m/z	Relative Intensity
169.2364655	0.32
179.2516174	1.07
197.4165649	0.53
223.1903229	1.98
241.2474670	3.53
259.1869507	100.00
400.4733887	0.47
441.2583008	0.16
475.0116577	0.15
501.5363159	0.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	697.22
Annotation	Unknow
Peak:m/z	Relative Intensity
203.0228729	0.14
213.0910950	0.20
349.0043335	12.93
386.9561768	0.10
445.8578491	0.22
467.5662842	0.07
519.8102417	0.06
522.9494019	100.00
523.6720581	0.20
528.9556885	0.47
560.9716187	0.35
567.1940918	0.08
610.9978027	0.17
612.6471558	0.13
624.3404541	0.18
651.3311157	0.10
658.3175049	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	573.1862
Annotation	Unknow
Peak:m/z	Relative Intensity
183.1717682	0.37
184.0360718	1.12
186.1843414	0.07
199.0123291	0.11
199.9112244	0.33
210.9877472	0.07
227.0995026	0.08
253.0757904	0.12
258.1449890	0.04
259.4656982	0.05
263.9652405	0.09
266.1151428	1.15
267.0222168	0.30
268.1966248	1.26
269.0885315	0.44
272.2475891	0.16
281.1406860	0.08
310.0400391	10.94
311.1856689	3.61
312.2690125	11.71
313.1347961	100.00
314.2037659	1.87
315.0930786	0.14
316.2313843	0.34
330.2044067	0.07
336.1070557	0.09
354.1849976	1.93
355.2976074	0.48
356.2081909	0.37
357.1378784	0.23
362.7210083	0.04
378.9327393	0.72
380.5167847	0.33
381.1853638	0.04
382.3932495	0.06
383.3220215	0.26
397.2146606	1.07
398.1193237	0.15
399.2203369	0.92
400.2352295	0.11
405.3719482	0.20
408.3886108	0.08
410.2922363	0.06
412.5097656	0.04
413.6306763	0.16
416.4605713	0.05
423.2441406	1.08
424.2504272	0.67
425.1735840	0.10
426.1372681	0.16
441.1353760	14.37
442.1635742	5.39
443.1715088	2.85
444.2642212	1.25
453.2305298	0.05
466.6458740	0.03
481.2175293	0.04
483.3500366	0.03
484.1884155	0.05
485.3100586	0.57
486.1246338	0.07
493.4446411	0.21
499.3346558	0.25
510.2969360	5.72
511.2162476	1.28
519.5319214	0.04
528.1563110	0.89
529.2647705	0.73
536.3677979	2.00
537.2999878	1.91
542.5309448	0.10
554.2846069	10.48
555.3900757	11.43
556.5581665	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	167.06
Annotation	D-Xylonate
Peak:m/z	Relative Intensity
58.9493561	23.85
72.8536072	82.03
74.9105530	36.71
86.2393341	0.23
90.9582825	1.06
92.8715973	61.84
104.4040833	0.15
106.8097076	100.00
107.4256744	0.14
108.9434662	13.21
109.9832001	0.11
112.9106293	0.11
114.8674927	0.16
117.4314880	0.21
119.3816528	0.23
120.9173584	0.70
124.9232025	74.39
125.9171448	2.05
138.2090912	0.19
139.1038513	0.47
146.1228027	0.37
147.1816559	0.35
147.8831940	0.30
148.9824524	2.26
155.3919220	0.74
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	188.07
Annotation	Indoleacrylic acid
Peak:m/z	Relative Intensity
118.1030426	0.47
142.1141205	0.80
144.0372162	10.64
145.9940796	100.00
160.0773468	0.59
170.0822906	3.82
179.6980438	0.07
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
106.9308472	0.05
109.0232849	0.11
120.0717773	16.54
120.9550018	100.00
123.0941772	0.06
125.0814972	0.05
125.8777313	0.05
132.0410919	0.29
139.0714111	0.05
142.6063232	0.02
143.5339508	0.05
148.9454803	2.07
150.0160370	6.48
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
71.9087753	8.91
72.6061554	0.05
106.8642883	0.14
118.0366516	100.00
130.0599976	0.77
148.0334930	1.12
153.2654724	0.27
156.2445679	0.10
184.1914673	4.41
189.1285248	0.11
190.1785583	0.54
201.0876312	1.16
206.0824127	0.06
223.0157166	0.33
229.2233887	13.22
230.1178589	39.94
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	259.1187
Annotation	Glycerol tripropanoate
Peak:m/z	Relative Intensity
80.8950806	0.04
115.0756073	0.12
128.9785156	0.07
137.0983734	1.65
139.2359009	0.08
140.9355164	0.04
143.1479645	0.18
150.1124115	0.05
155.1715546	5.94
161.1080475	0.19
171.0626373	0.26
173.0062103	0.04
175.1072540	0.16
181.2004547	0.97
187.1887207	0.07
190.9638062	0.07
197.0664520	0.30
199.1742554	50.78
201.1629486	0.15
213.0341339	0.29
215.1238708	1.19
217.1304932	100.00
218.0890808	0.06
221.0653992	0.26
222.0403595	0.08
223.2534332	0.38
229.0747528	0.03
239.1524658	0.06
241.1022949	1.73
244.2729645	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	481.1133
Annotation	Cadensin B
Peak:m/z	Relative Intensity
139.0394592	0.18
153.1201019	0.34
169.3157654	0.11
171.1475830	1.96
173.0281677	0.21
173.9777527	0.08
175.0504913	33.79
176.1789703	0.45
179.1854248	0.21
197.1978455	0.19
215.1429749	2.37
229.0807343	0.43
246.4790802	0.13
253.2102356	0.15
264.0755310	0.42
287.1966858	1.62
296.4243164	0.04
305.1111145	100.00
306.0679932	0.04
341.2829285	0.85
347.1530457	0.68
382.5318298	0.05
392.7747498	0.03
393.8464661	0.05
401.5172119	0.09
421.6379700	0.07
450.3567200	0.13
463.1349487	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	410.1217
Annotation	Unknow
Peak:m/z	Relative Intensity
126.9611206	1.18
129.8605652	0.10
143.9622498	0.29
144.9805298	41.13
153.0190735	0.47
177.0019073	5.78
177.9766846	1.20
181.2836914	0.45
187.9891052	1.18
194.8947601	3.38
199.2019806	3.84
205.9573364	1.66
209.3510742	0.19
229.3431091	1.42
230.0881042	1.30
237.9942017	0.24
256.2084656	17.10
260.8652039	0.36
263.1319580	2.23
274.0938110	54.11
274.9711609	0.22
277.3114319	0.42
281.1477356	100.00
288.1349487	3.89
288.8013916	0.47
290.0318604	0.36
292.4773865	0.28
293.1695251	0.37
302.1604004	0.43
306.1762390	50.67
311.9535522	0.10
318.9823608	5.12
320.0462646	18.00
321.1506348	0.13
322.9616089	2.49
324.1630859	30.86
334.0256348	0.38
334.9710083	0.19
349.9578247	0.68
364.3709106	0.16
392.2960510	11.77
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	419.1347
Annotation	RHAPONTIN
Peak:m/z	Relative Intensity
149.9441223	0.37
173.2694092	0.10
191.2734375	0.36
211.289505	0.16
213.2091217	45.82
214.2625122	0.12
220.0542603	0.19
227.207077	1.24
233.1086426	0.10
235.0072327	0.31
239.3052063	0.08
245.3608093	0.31
253.1551208	0.11
255.0751038	1.34
257.0891418	100.00
257.7479248	0.57
262.866272	0.16
267.2806702	0.56
269.0163574	0.82
271.0062561	0.40
284.5744934	0.32
285.3057556	0.07
288.9517822	0.45
290.1664124	0.23
294.5683289	0.31
298.5758972	0.23
299.1768188	6.26
315.220459	0.26
321.4125061	0.46
323.3245544	0.13
329.2651062	1.42
341.4967651	0.43
346.1675415	0.16
347.0327148	0.47
352.1541443	0.10
355.4463501	0.14
358.057373	0.68
359.3526917	0.62
361.1028137	0.28
365.2442627	0.65
372.0252991	0.13
373.3923645	0.83
375.3564758	0.39
382.1552124	0.22
383.2333069	0.46
393.3141785	0.15
401.1013794	1.61
403.9632874	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	340.2838
Annotation	Oleoyl glycine
Peak:m/z	Relative Intensity
98.1726990	0.06
99.9944611	0.14
102.9762268	0.20
105.0256805	1.44
106.2697449	0.22
107.0560913	0.76
108.9472656	1.61
110.1967621	0.35
111.2857208	0.23
112.5536957	0.50
114.7917252	0.19
116.9042969	1.76
118.3838425	0.32
119.1066895	2.11
119.9497986	0.56
120.9549103	3.12
122.1768646	0.65
123.0126724	1.41
124.0911560	0.64
124.9313507	0.32
125.9505310	0.21
127.4321671	0.23
128.1450195	0.46
129.0998230	0.54
130.2915649	0.62
131.0245056	2.54
132.0842896	0.68
133.1259766	2.95
134.0517578	0.40
135.0046387	2.45
135.9257812	0.85
137.0721130	1.84
138.9161835	0.29
140.1001587	0.51
141.0589905	0.32
141.9691925	0.37
143.0497742	1.49
144.0619354	0.71
145.0562134	2.12
145.9069824	0.21
147.0650635	3.60
148.2024841	1.14
149.0631409	2.62
150.0646057	0.35
151.0821228	1.24
152.0375671	1.33
153.1678772	0.23
154.2547302	0.66
155.0299072	0.12
156.1930847	0.14
157.0696106	2.18
158.4770203	0.42
159.1294403	1.32
160.3822021	0.51
161.1553040	3.07
162.2631836	0.87
163.0711975	2.22
164.0864563	0.20
165.0980530	0.81
166.4317017	0.07
167.2014771	0.48
168.7673035	0.02
170.1582794	1.19
171.1404572	2.51
172.1732941	0.27
173.1952515	1.73
174.0839844	0.30
175.1183472	4.79
176.1775513	0.64
177.1295776	0.99
177.9616699	0.43
179.1898499	0.70
180.2974091	0.41
181.2358246	0.26
181.8574371	0.09
183.0855560	0.27
184.2320099	0.76
185.3077698	2.41
186.4275665	0.89
187.1794739	2.42
188.0264740	0.17
189.2256012	2.87
190.2874908	0.27
191.0819550	0.51
192.2538452	1.00
193.3253021	1.07
194.2444153	0.08
195.2605743	0.04
196.3245697	0.11
197.3048401	0.24
198.2173309	0.33
199.1442871	2.24
200.1092987	0.19
201.1383057	1.42
203.1482544	2.00
204.2324677	0.31
205.3148193	1.27
206.3258972	0.50
207.1429291	0.06
208.0766296	0.51
209.3080139	0.17
210.2497864	0.57
211.2415466	0.57
212.1213684	0.27
213.2123718	1.19
214.2022095	0.10
215.2774048	0.51
216.2304993	0.06
217.2511902	1.09
218.3560181	0.30
219.1121826	0.15
220.5213623	0.98
221.2905579	0.23
222.3869324	0.40
223.1942749	0.14
225.1029358	0.23
226.8955383	0.97
228.2325439	0.44
229.3417053	0.55
231.2272949	2.50
232.1782837	0.46
233.3076172	0.95
234.2028198	0.34
235.2821045	0.12
236.0110474	0.09
237.2143860	0.12
241.2743225	0.66
242.1846008	0.39
243.2316895	1.21
244.2117310	0.86
245.2140503	4.11
246.4163513	0.53
247.3898315	0.50
248.3688660	0.14
249.4790649	0.40
250.2862244	0.13
251.0267944	0.32
253.2832031	0.30
255.4273071	0.07
257.3231812	2.05
258.2929993	0.59
259.2820740	0.49
260.2008667	0.22
261.5278320	0.44
262.5937195	0.57
263.2976685	0.32
266.3419800	0.08
267.5914612	0.20
269.2869568	3.61
270.5423279	0.95
273.7321777	0.70
274.3656616	2.09
275.3264160	1.52
276.4563599	0.67
277.3281250	0.25
278.3772583	0.75
279.0162659	0.04
280.4970398	0.48
281.3483276	0.49
283.2035522	0.75
284.5175476	0.19
285.1730957	0.08
286.2337341	4.21
287.3475342	4.14
288.4186707	1.21
291.4208984	0.06
292.3698120	0.57
293.4405518	0.32
294.9722900	0.95
297.2384033	0.16
298.3425293	0.40
299.2538452	0.23
300.1019287	0.64
301.0196838	0.21
302.3418884	0.10
304.3127441	63.07
305.4306030	18.28
310.0260925	0.16
310.9034424	0.15
312.2797852	0.09
313.3334961	0.53
317.6129761	0.06
322.2857971	100.00
323.3075562	47.22
324.0239258	0.16
324.6787720	0.23
339.2854614	0.09
341.3732605	0.34
349.1205750	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	247.13
Annotation	Leucyl-Aspartate
Peak:m/z	Relative Intensity
72.1653290	0.23
83.8250122	0.18
86.0297165	1.04
99.2531586	0.04
114.9041138	0.16
115.8226166	0.08
117.0209198	0.08
118.1112976	0.79
124.1981354	0.24
127.0994110	0.17
132.0504303	6.52
132.8927307	0.21
151.0756683	0.08
154.0476837	0.26
155.9691925	0.89
156.9033661	0.33
159.2252045	0.17
161.1646881	0.16
163.3901825	0.46
167.1203156	0.23
169.2415314	0.15
171.1215363	0.19
175.0366669	0.13
183.0675201	5.32
183.9927521	0.38
185.2335968	0.13
185.9731445	0.17
187.0361176	2.72
189.0139465	0.54
200.0366364	0.07
201.1731262	33.77
204.9488525	0.82
206.0835724	0.22
210.8104706	19.92
212.0854340	6.94
213.0607147	0.17
215.0840302	0.12
219.1229095	0.34
226.2621613	0.80
229.0093384	100.00
230.1434326	1.63
231.3162994	0.07
241.4777832	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	355.0983
Annotation	Entadamide C
Peak:m/z	Relative Intensity
107.9022675	14.98
114.0035400	0.42
116.1687012	0.15
127.9464874	0.33
132.0010376	0.16
132.8794708	0.26
133.6978912	0.25
143.9050446	0.27
160.4651337	0.39
175.1428986	0.49
177.9528503	24.19
191.2211914	0.13
192.6143646	0.19
199.3940125	0.23
221.1850891	0.34
235.1641846	0.35
239.0933838	0.24
243.0778198	0.52
247.1513367	0.39
248.9147034	0.15
250.0503540	1.78
265.0174561	100.00
266.0943909	0.35
268.0291443	29.46
272.2713013	1.55
273.5236816	2.96
274.1913452	1.52
280.1530762	0.60
284.7212524	0.33
293.2864990	0.54
294.2865601	0.14
295.1533203	0.19
297.2625732	1.75
313.7692566	0.88
319.3334961	0.19
324.3199158	0.21
327.2356873	0.70
331.2746277	0.12
336.2217407	0.59
337.2167358	2.06
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
66.04429626	0.62
108.8479156	2.83
109.8408813	1.22
115.0156708	2.29
115.8884735	1.21
122.1419067	0.69
129.1774597	4.49
130.0666962	0.82
141.213913	0.68
145.0514069	2.14
147.0918732	0.75
151.0890961	44.99
152.0531311	39.77
152.9398499	2.48
156.0108795	8.51
158.0536041	1.42
164.3140869	1.49
166.1866608	1.09
168.2214203	2.07
170.1739807	4.12
176.015274	3.58
179.9562988	1.15
184.029068	4.59
185.259903	3.15
186.0429535	3.01
194.072876	1.61
197.8326874	10.45
198.4765015	2.52
200.266922	0.82
205.9782562	18.99
211.3695831	1.54
212.0864868	3.63
218.0584869	8.06
226.0508881	8.23
235.5274048	5.10
236.1534576	31.11
237.2187042	4.21
238.0136261	1.68
239.2659912	8.07
244.9717865	3.29
252.0372772	6.66
253.0844727	100.00
254.1398773	41.97
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	735.4078
Annotation	Unknow
Peak:m/z	Relative Intensity
213.2281494	0.10
228.8720703	0.08
253.0043182	0.05
339.0675049	0.14
386.5418701	0.91
387.1688843	12.04
393.8814697	0.17
406.1284180	0.07
542.7610474	0.35
561.1240845	100.00
561.9807129	0.21
594.0668945	0.11
601.9498291	0.12
637.1644287	0.39
648.0565796	0.18
648.9476929	0.23
650.1510010	0.07
650.9721680	1.25
656.9901123	0.21
672.5039673	0.13
688.7423706	0.32
706.9570923	0.19
734.2963257	0.07
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
87.9619904	0.03
99.0667419	0.04
116.0448837	1.18
119.8896027	0.34
129.9670410	0.25
131.1659851	0.04
144.9376068	64.15
148.1064148	0.24
157.1935730	0.02
161.9546509	100.00
170.0408630	0.44
188.9506531	0.08
200.1842957	0.11
203.4081421	0.02
217.0867310	0.08
228.1336670	1.67
229.0180664	0.02
233.2931824	0.03
244.2106934	0.07
245.0913696	0.16
249.1079712	0.47
255.0030823	0.03
273.1448975	2.24
274.0636902	7.95
281.1890259	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	558.0865
Annotation	Unknow
Peak:m/z	Relative Intensity
173.7980652	0.25
191.9771729	0.45
198.1667786	0.32
216.0759583	0.23
225.9526062	2.22
227.3475952	1.48
228.0178375	0.18
229.1711731	1.37
230.0317230	0.44
231.2194672	0.59
234.0154724	0.53
238.0235138	10.01
239.0385132	4.30
240.2173462	1.68
244.2237091	0.88
247.1714172	0.33
248.1072693	1.03
248.9865112	0.73
256.1333008	4.72
257.1179504	5.19
265.1860962	16.31
266.1754150	12.00
267.2298584	3.61
274.1278076	33.75
275.1611328	28.02
275.9992371	38.91
306.0516052	18.04
307.4104614	0.21
330.1337280	2.05
333.0555420	0.51
335.6251221	0.21
343.3098145	0.78
347.6843262	0.99
348.4208984	1.62
360.2193604	0.67
362.1791382	0.35
366.0454102	3.98
377.1427002	1.70
378.0944824	14.04
379.1494751	0.73
385.3895264	0.60
396.0240479	97.05
398.2039185	0.72
427.4259033	0.23
438.2535400	2.54
450.3508301	0.32
464.6857910	1.16
468.1540527	2.68
472.5791626	4.90
473.2546997	14.15
474.2945557	4.58
490.6740112	1.02
492.0021973	0.37
503.3883057	11.90
504.3842163	1.68
513.0989380	0.37
520.6080933	2.81
521.2788696	6.66
522.3014526	4.27
537.9378052	0.25
539.2770386	100.00
540.3839722	25.35
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	465.1024
Annotation	6-Hydroxytricetin 5-rhamnoside
Peak:m/z	Relative Intensity
144.8906555	0.07
204.9509583	0.04
275.1470642	0.01
303.0967712	100.00
315.2511597	0.05
327.2172852	0.02
345.4569092	0.09
355.3770142	0.02
361.4719543	0.01
362.2980957	0.01
369.1674805	0.02
372.9547424	0.02
399.2798462	0.08
411.3028259	0.04
423.9476318	0.01
429.4377136	0.01
447.0930481	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	468.0917
Annotation	Unknow
Peak:m/z	Relative Intensity
141.8773956	0.06
161.1686249	0.07
163.0929260	0.16
167.2593231	0.22
170.1016388	0.46
177.1075439	1.59
185.6752014	0.05
193.8851471	0.97
202.0201263	0.20
211.0770721	5.23
220.0291138	0.09
224.1101379	0.18
235.5819550	0.62
236.2228088	0.81
246.1032715	0.60
246.8718567	0.15
263.2687988	0.11
264.1265869	0.34
265.2366333	0.37
277.2162476	0.62
293.4381409	0.38
294.0518799	0.07
304.3828125	0.06
305.8093872	0.08
309.0938110	0.09
314.9276733	0.08
320.0601196	0.18
321.2078247	0.73
322.0790405	1.95
327.5526733	0.16
339.1860352	100.00
360.5718384	0.16
364.4359741	0.30
384.3430481	0.06
389.2385254	0.35
393.1233826	15.31
393.7598877	0.04
408.7235718	0.23
418.2761536	0.48
421.6298218	0.09
423.6083679	0.15
431.2597656	0.06
433.0232849	0.08
436.2829285	1.96
442.4856567	0.09
450.0276184	1.25
451.3133545	2.38
467.7055969	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	725.4082
Annotation	Alliospiroside C
Peak:m/z	Relative Intensity
221.3253174	0.19
223.3443298	0.15
225.1636353	0.64
227.3223267	0.19
233.3298950	0.27
242.4132385	0.45
249.0978241	1.59
251.1779327	8.00
252.2587280	2.12
253.1872559	1.09
254.3953552	0.50
263.2124634	0.47
269.2298889	19.06
270.3302612	5.38
271.4958191	1.23
272.6300049	0.21
278.1819458	0.29
278.8882446	0.57
281.4116211	2.73
287.1809692	8.77
288.2699280	1.72
298.3072510	0.34
299.4567871	0.81
301.4479675	0.50
313.3515625	0.46
314.0379639	0.63
317.2539978	0.29
323.2749634	1.65
327.2595215	0.23
335.3045654	0.39
341.0972900	0.11
347.4737549	0.78
349.2974548	0.22
350.3711548	0.58
355.3335571	0.15
360.5230713	0.48
364.5412598	0.60
365.2615967	1.29
365.8815308	0.28
366.5611572	0.17
371.3923950	0.76
377.6301270	0.45
378.6162720	0.17
383.4404297	2.98
385.5690308	0.15
389.3977051	0.33
391.1085815	0.44
393.4145508	0.62
395.3178711	2.29
396.4655762	0.79
401.1351929	2.16
402.2202148	0.25
413.3229370	10.53
414.2709961	2.67
417.3352661	0.56
419.3128052	29.18
420.3063354	8.64
427.6427002	0.14
430.1921387	0.51
431.3781738	11.27
432.2957764	2.26
470.4882812	0.25
497.4398193	0.46
509.5825195	0.17
521.1196899	0.71
527.3045654	0.81
528.2477417	0.19
545.4041748	3.37
546.5080566	0.17
557.3368530	1.75
559.4534302	0.12
563.3726807	100.00
564.4860229	28.25
575.2944336	0.53
575.9539185	0.31
581.3445435	0.17
582.3997192	0.45
590.8131714	0.69
593.3925171	0.37
594.1898804	0.37
604.1218872	0.21
611.3708496	0.81
635.1682739	1.03
636.3272095	0.27
636.9794922	0.34
645.8986206	0.44
662.2908325	0.19
671.3899536	1.11
680.6542358	2.28
681.4646606	0.32
683.1760864	1.04
689.4555054	2.18
690.4921875	2.60
707.7357178	1.40
708.3424683	0.15
709.5341187	0.35
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	397.14
Annotation	Unknow
Peak:m/z	Relative Intensity
204.9310760	0.62
251.1611633	100.00
268.1665039	0.43
281.3274841	0.29
298.3398132	1.19
310.1132812	0.78
313.2388916	0.45
337.0795593	1.39
350.9662170	2.95
355.3035583	0.66
356.1110840	0.31
378.9972229	0.22
379.8724976	0.96
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	616.9
Annotation	Unknow
Peak:m/z	Relative Intensity
199.1084747	0.14
200.0797729	0.08
201.0496216	0.05
217.1873474	0.06
229.2847290	0.04
230.9948425	0.07
273.0963745	8.52
274.1072693	3.49
274.9890442	3.47
276.0088501	0.03
387.0697021	13.54
388.0051880	10.31
389.1009521	14.86
390.0153198	0.07
402.9699097	0.02
486.1748657	0.13
487.1608276	0.12
501.0437622	36.47
501.9851685	73.13
502.9721680	100.00
503.5965576	0.37
513.4295654	0.06
514.3291626	0.05
524.1565552	0.02
528.8634033	0.04
530.3636475	0.05
531.1470337	0.05
533.2236938	0.08
542.1730957	0.03
542.9674683	0.20
569.8540649	0.19
570.5852661	0.23
571.1964111	0.04
572.1174316	0.21
573.0361328	0.43
584.1233521	0.05
588.2556763	0.03
589.1248779	0.04
598.5562134	0.19
599.3038940	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	381
Annotation	Unknow
Peak:m/z	Relative Intensity
204.1005249	0.62
212.9268951	3.11
232.8300171	0.28
235.1497192	0.28
237.1203613	0.19
243.2192993	0.13
251.0849915	0.46
255.3818665	0.42
282.9964600	0.38
296.8057251	100.00
321.0243530	0.86
335.0952759	0.18
361.3040771	0.51
362.2377319	2.84
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
85.9602966	0.56
110.1484146	0.11
110.9710236	0.05
127.9779282	100.00
128.9866333	39.21
130.0403442	5.21
153.1380615	2.38
154.0060425	1.50
155.0158844	0.06
159.7353516	0.53
161.0525360	1.06
162.1662292	0.25
163.3064270	0.07
171.1743927	13.74
172.1303101	6.52
173.0932617	0.74
175.0758972	0.28
178.9977875	0.40
180.1553802	0.10
180.8395081	0.18
196.8707428	1.04
198.1391907	0.88
199.1462708	0.05
199.7504578	0.14
204.3044434	0.07
205.1038208	0.29
215.1712036	11.72
216.1760864	9.59
217.2036743	2.35
244.3316040	0.24
247.3593750	0.08
253.4417419	0.19
254.0821838	1.57
255.2799072	1.44
272.1359253	19.38
273.0992126	17.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	576.0978
Annotation	Unknow
Peak:m/z	Relative Intensity
218.9933472	1.91
321.1076050	1.32
330.3073120	0.38
348.1784058	11.67
380.1442871	1.34
428.8184204	1.45
444.2796021	0.63
445.7606812	3.56
447.2329102	1.08
451.9947510	0.17
486.0693970	0.80
487.2868042	1.16
496.3054199	0.54
512.0767212	1.29
517.5279541	0.56
531.9436035	0.24
539.0880737	0.40
542.1667480	0.52
544.1530762	0.66
558.1381226	100.00
559.3484497	0.50
575.9277954	1.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	215.03
Annotation	D-Hamamelose
Peak:m/z	Relative Intensity
70.9416580	0.14
87.0254745	0.13
88.9554977	1.56
100.2322388	0.03
101.0921783	0.15
106.8236542	0.22
113.0550232	0.76
118.9238586	2.62
124.8679047	0.19
130.9393768	0.76
143.0094757	2.56
149.0528717	0.48
160.9577789	6.40
176.4614868	0.08
177.4472656	0.14
178.9913177	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.1146
Annotation	Lactulose
Peak:m/z	Relative Intensity
145.1736298	0.08
149.2515259	0.06
178.9924011	0.05
184.5561371	0.08
203.2281494	0.03
207.2421570	0.03
211.0681000	0.07
222.9983215	0.07
224.3011169	0.04
236.0751648	0.06
239.0109558	0.06
241.3542480	0.05
253.9315186	0.04
255.0459900	1.77
257.0466919	0.06
258.3149414	0.18
263.2142639	0.03
268.8027954	0.03
270.0722961	0.08
283.3050842	0.03
285.5148621	0.07
297.0810852	0.05
299.0398865	0.03
306.1181641	0.07
311.1093140	0.04
313.2288818	0.07
322.8411255	0.03
324.5722351	0.15
325.2505798	0.03
329.1885376	0.04
341.2200317	100.00
342.3686829	0.01
343.1350098	0.02
344.2296448	0.02
351.5440063	0.03
369.1568604	3.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	354.0777
Annotation	Unknow
Peak:m/z	Relative Intensity
111.9788513	0.13
117.7423248	0.14
121.9284821	0.29
130.0118561	1.88
131.1077881	0.08
137.2129517	0.03
160.1068115	0.12
176.9991302	4.93
179.0206909	0.11
195.9432220	0.04
207.9182129	13.08
225.0962219	100.00
248.2614746	0.17
251.0043945	0.11
260.9458313	1.10
265.4539185	0.05
272.2199707	0.06
279.1040039	9.99
289.7021179	0.21
291.2614136	0.20
295.3973389	0.05
306.0994263	0.24
308.2082520	0.08
309.3058472	0.06
312.7553711	0.11
318.3258362	0.16
320.5765686	0.04
331.2270813	0.10
336.1144104	2.90
337.2424927	0.53
349.2241516	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	414.0809
Annotation	Unknow
Peak:m/z	Relative Intensity
129.1492004	0.07
131.1016846	0.60
135.0751953	0.08
136.7834473	0.07
143.0808258	1.04
149.3802032	0.32
158.9591370	0.15
159.9618225	0.15
161.1688080	0.38
162.0303040	0.17
163.1008606	0.22
165.0400085	0.07
171.0872192	0.14
177.9894714	0.52
182.0062714	0.39
187.3716431	0.12
192.9379425	0.38
194.1105652	0.13
197.2230682	0.19
198.1904907	0.23
204.0155182	0.23
208.9772186	13.39
215.0696564	0.19
217.2560425	0.80
218.3347931	0.46
219.2549133	0.18
228.1562805	0.12
229.2212830	0.14
233.1393127	0.17
236.5041809	0.07
241.0053406	0.23
247.3192139	0.18
249.0083313	0.08
267.9289246	6.07
269.4510193	0.06
280.4929810	0.12
281.4661560	0.14
285.0144043	100.00
285.6232300	0.86
289.0421143	0.19
294.2024536	0.21
297.2579346	0.32
301.2227173	0.32
313.0662231	0.31
315.5781250	0.11
320.9365845	0.63
323.3012085	0.09
324.3125610	1.37
339.0944519	11.42
348.7515259	0.07
351.1194458	0.85
353.3438110	0.55
355.1910400	0.93
368.0628662	0.34
368.7867737	0.17
369.4294434	0.17
370.2032776	0.14
372.9993896	0.39
377.1945496	0.22
379.1854248	0.26
382.2606201	0.10
385.2061157	0.24
391.2807312	0.27
394.9834900	0.54
395.7824402	5.00
396.5472107	1.38
397.2859192	0.51
404.4527893	0.52
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	188.07
Annotation	Indoleacrylic acid
Peak:m/z	Relative Intensity
95.9246979	0.02
117.9751892	0.44
129.0825348	0.03
141.9455261	0.55
144.1083832	9.71
145.9863129	100.00
146.8412628	0.10
160.0180817	0.73
163.9435577	0.03
170.0724945	3.90
188.2265472	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	705.1829
Annotation	Lychnose
Peak:m/z	Relative Intensity
363.2200928	2.52
381.1790771	4.53
423.3264771	0.15
508.9548340	0.23
525.4348145	1.28
543.2887573	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	556.1797
Annotation	Baumycin C1
Peak:m/z	Relative Intensity
164.0583496	0.08
171.8581238	0.23
192.0351715	0.86
195.7601624	0.10
196.5568237	0.08
201.7337341	0.10
210.0413055	0.16
220.7926636	0.17
225.9895172	2.70
226.5933228	0.15
230.0870056	0.75
238.0820007	14.41
247.0264435	0.72
248.0966492	1.67
256.0234070	8.83
265.1479187	26.04
274.0814209	52.14
277.2792358	0.48
331.3964233	0.12
373.4440918	0.21
375.1402588	0.13
381.2984009	0.46
391.3132935	0.27
394.1547241	0.68
405.9729004	0.53
419.8020020	0.72
445.1906738	0.11
450.9010620	0.41
460.3470459	0.10
463.1505737	0.46
472.2401123	23.16
472.8576660	0.21
481.2962646	0.09
502.2980347	8.67
520.2321167	8.35
538.2299194	100.00
538.9175415	0.14
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
145.7810822	0.06
196.3967285	0.31
211.3627472	0.07
214.1606140	2.22
215.0936432	0.09
226.2250671	0.13
248.6638184	0.13
253.7794495	0.07
281.3668823	100.00
282.3471985	26.09
295.2197876	0.34
299.3264465	0.16
316.1771240	0.14
317.1069946	0.24
323.1726685	0.12
325.1823730	0.08
327.1436768	0.12
333.5671692	0.08
337.2742310	0.09
359.3255615	0.11
389.1550293	0.08
392.9082336	0.42
393.8530273	0.22
398.5840149	0.07
411.3641052	0.11
417.1421814	0.15
419.8266907	0.06
423.0433044	0.18
433.8361206	0.04
435.4685974	0.59
442.3040466	0.12
443.3971252	0.45
444.3535156	0.08
449.6979065	0.06
451.1987915	0.14
460.4190063	0.21
461.3257446	1.58
462.3870239	0.06
477.4086609	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	242
Annotation	Unknow
Peak:m/z	Relative Intensity
81.0867157	0.22
135.1744843	0.17
143.7180634	0.31
153.9638519	0.17
165.2464447	0.37
182.9205475	3.57
195.0706482	0.64
196.0327759	2.79
196.9446259	0.34
198.2790680	0.32
198.9462128	0.24
199.9158020	1.46
200.9557953	89.58
212.2388763	0.18
214.1231842	0.91
217.3678436	0.45
218.8644104	16.14
223.9073944	100.00
226.1425629	0.40
230.8681488	0.60
231.7724609	0.59
233.3504486	0.45
234.1376953	1.01
237.0869293	0.23
239.9723969	0.16
241.8404083	12.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	297.24
Annotation	cis-9,10-Epoxystearic acid
Peak:m/z	Relative Intensity
84.89084625	0.11
95.0381546	0.08
98.88829041	0.16
108.0827713	0.17
118.96035	0.14
127.0586853	0.30
153.0044861	0.10
160.9730988	0.25
170.0791321	3.31
181.2141418	0.75
183.017395	100.00
184.0623779	8.27
185.0674744	0.48
195.1110992	0.63
197.0575256	6.47
198.1183777	5.03
199.0715637	0.13
203.2063293	0.13
211.0947876	1.78
212.0392761	2.51
213.2269897	1.92
222.9498596	0.98
225.2738953	9.87
226.1760254	1.96
227.2436218	0.31
229.1178589	0.23
233.2107849	2.76
234.2632446	0.23
235.3601074	0.16
239.1242981	1.10
240.1645813	3.35
241.1735229	0.08
242.1170654	0.23
251.3218384	0.40
253.291748	45.71
254.1272278	2.41
255.3579407	0.31
260.1035461	0.39
261.9034424	5.23
267.340271	0.16
268.1716614	0.16
269.0355835	0.47
270.4693298	0.17
279.2705383	22.29
281.6187134	0.22
297.2341309	7.45
298.4672852	0.85
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	611.1586
Annotation	Isoorientin 6''-O-glucoside
Peak:m/z	Relative Intensity
228.9797211	0.07
231.0181885	0.10
241.1282349	0.09
253.2125244	0.10
271.1434326	0.13
287.1265259	27.89
297.2414246	0.06
312.0754395	0.06
313.4421997	0.11
314.2662354	0.06
329.2681885	0.09
343.2561646	0.04
353.2947998	0.18
355.2086182	0.08
361.3233643	0.16
383.3576050	0.11
395.1446533	0.18
409.3902588	0.12
413.3920288	0.15
431.1671143	0.57
449.1976929	100.00
449.8485107	0.18
458.9135132	0.19
464.9651489	0.09
476.7416382	0.05
480.2498779	0.16
490.1570435	0.07
491.3732300	0.04
515.3590088	0.05
519.1138306	0.05
522.5606079	0.02
535.3489380	0.05
536.1845093	0.07
545.1632690	0.05
551.4122314	0.05
563.5621338	0.04
565.0752563	0.07
570.5102539	0.06
575.3681030	0.15
578.3808594	0.04
584.7331543	0.04
590.8479614	0.11
593.3253174	0.71
594.5997314	0.15
599.1336060	0.34
611.2713013	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	625.141
Annotation	Myricetin 3-neohesperidoside
Peak:m/z	Relative Intensity
284.0977173	0.01
292.2941284	0.00
301.1928101	5.87
332.3472900	0.07
343.1698608	0.82
376.4413452	0.02
377.2256470	0.03
387.3104248	0.01
388.1990967	0.01
403.2730713	0.01
445.1745605	0.05
463.2091064	100.00
464.0145874	0.02
476.3079834	0.02
505.2120972	0.28
517.5885010	0.03
519.3253784	0.04
534.0755005	0.02
535.3162842	0.02
548.5497437	0.03
565.2611694	0.01
578.3613892	0.10
581.0654297	0.05
601.5791626	0.02
607.1853638	0.07
616.2006226	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	463.0885
Annotation	Spiraeoside
Peak:m/z	Relative Intensity
222.3005676	0.24
230.1792603	0.59
267.5194397	0.28
278.9796753	0.48
283.2792664	0.37
301.0419006	100.00
319.2790222	0.37
321.4177246	0.78
335.5061951	1.88
374.3759766	0.87
379.2258301	0.45
399.2243958	0.67
400.7672729	0.55
406.9671021	0.49
417.4404907	2.45
419.1289673	1.16
427.3215637	2.55
445.3453674	2.22
448.8181152	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	331.1641
Annotation	Quinocarcin
Peak:m/z	Relative Intensity
110.9383850	0.36
119.9878387	2.80
149.2502747	0.74
166.0167084	100.00
166.7687683	0.06
176.1067505	0.53
178.0984497	0.38
193.1617737	0.93
197.1038818	0.08
253.1208496	0.15
255.1468811	0.44
259.0440674	0.33
271.2142334	0.19
300.5964966	0.14
313.1769104	2.96
314.0880127	0.45
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
86.68881226	1.23
98.98825073	1.96
100.9395447	0.59
105.0005035	2.25
105.791748	0.93
120.8341675	0.79
123.8520508	0.49
125.0307617	2.01
133.0380402	2.49
137.0570068	1.61
148.8670959	5.05
149.9835663	1.13
152.7559662	0.59
161.1027069	2.40
165.0667877	2.20
169.0442047	1.32
173.8935699	0.59
174.9991455	1.37
177.078537	0.73
178.3577881	2.43
179.1842194	1.75
180.2255707	1.44
186.9692383	1.84
189.2964935	1.89
190.9966583	2.61
192.7668915	4.21
193.3772736	1.59
195.3546753	3.14
204.1882172	2.74
205.2642212	0.98
206.0124969	1.42
207.2549591	30.96
208.1508942	5.10
209.1604767	4.32
215.1166077	0.69
217.3800354	0.83
221.5086365	2.65
222.1916046	15.42
223.1668854	34.44
223.9503021	0.39
233.0938873	3.88
235.1872406	0.82
251.0828857	100.00
252.1587067	12.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	504.07
Annotation	Unknow
Peak:m/z	Relative Intensity
163.1103821	0.37
224.2533264	0.39
289.8887024	0.50
298.3184204	1.15
309.2846069	2.90
316.3046265	1.76
325.3730469	1.32
373.9662476	1.58
375.0710754	1.44
381.8398438	2.79
407.0890503	0.97
413.1040649	60.75
414.1922913	20.95
415.1189270	100.00
440.9809265	0.63
458.1939697	1.32
459.2686462	1.56
467.4498901	0.51
485.3011780	1.03
486.1968384	1.75
487.5635376	0.37
488.3862000	0.37
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	597.1821
Annotation	Geniposide pentaacetate
Peak:m/z	Relative Intensity
150.5308685	0.13
199.7777710	0.09
313.3896179	0.17
315.2666016	1.02
316.2726746	0.17
338.2911987	0.04
344.8541260	0.09
345.4852295	0.58
347.3854370	0.05
351.9983521	0.18
355.4116211	0.08
357.2282715	91.88
358.2813721	21.46
369.1579590	2.65
370.3771973	0.49
387.2786255	70.74
388.3541260	16.83
399.3493042	2.78
400.2877197	0.68
402.9390259	0.04
403.5547485	0.12
413.4979248	0.10
414.4351807	0.15
415.4694824	0.06
417.3014526	24.23
418.3562012	7.05
423.5468140	0.28
429.3196411	2.27
430.3599854	0.65
435.2317505	0.30
436.5146484	0.20
439.3560181	0.07
441.3248291	1.16
442.4248657	0.43
443.3995361	0.05
447.3195801	0.69
448.4249878	0.18
449.3632812	0.04
453.2825928	0.15
454.6057739	0.06
457.0668945	0.11
459.2825317	20.52
460.2892456	4.33
463.2615967	0.18
471.4229736	0.89
472.2858276	0.51
475.2077026	0.06
477.2112427	100.00
478.2155151	19.91
479.0187988	0.12
483.0947876	0.04
489.2388306	14.83
490.3553467	5.04
496.6528931	0.12
501.2225952	0.07
502.3196411	0.05
507.2232666	10.07
508.3023071	3.53
510.6109619	0.07
511.2384644	0.09
519.4682007	0.59
520.2828369	0.09
523.4661255	0.05
524.3267212	0.04
543.3743286	0.15
544.4575806	0.05
549.0045776	0.03
551.0360718	0.03
552.4530640	0.34
553.5697021	0.09
554.3522339	0.07
561.2868042	2.67
562.3287354	1.08
565.6923828	0.12
579.2904053	20.85
580.2125854	5.87
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	344.32
Annotation	Dihydroceramide C2
Peak:m/z	Relative Intensity
108.9094238	0.34
111.0930099	0.06
121.0616684	0.37
123.1360168	0.13
125.1748657	0.15
125.8765411	0.08
133.6320038	0.30
136.9185486	0.32
140.9480743	0.11
145.1109009	0.59
146.9957581	0.07
149.1526489	0.07
151.2160339	0.10
152.0786896	0.06
154.1622009	0.06
155.0073547	0.10
158.9640198	0.18
162.1185455	0.44
164.8478088	0.56
166.340332	0.06
169.1392365	0.14
171.1430511	0.20
175.1322937	0.29
176.3217621	0.20
177.2827759	0.19
179.2602539	0.07
183.0010376	0.14
185.329834	0.27
187.1454163	0.27
189.2186432	0.06
190.1473389	0.12
193.0454865	0.16
197.2045898	0.07
198.3325806	0.16
200.2445679	0.41
202.0431213	0.22
205.2165985	0.08
209.3473816	0.23
211.0932922	0.52
211.984436	0.06
213.322998	0.42
216.6812439	0.56
219.3843689	0.12
223.1352234	0.15
224.3187256	0.40
226.1948853	0.21
227.3162231	0.31
229.0477295	0.08
230.1724548	0.34
234.1247253	0.62
237.030365	0.58
239.2115784	0.13
243.2493591	0.64
246.0344543	0.20
247.3555603	0.87
248.3554993	0.33
251.1612854	0.35
252.3656921	0.07
253.76651	0.16
254.9969788	0.39
259.015625	0.31
259.7612305	0.09
260.4992065	0.30
261.9008179	0.21
263.2418823	0.07
265.4132996	0.23
266.5363159	0.25
269.149353	0.15
270.0970459	1.21
271.7884521	0.67
273.2541504	0.67
274.3823242	0.18
278.3961182	0.37
279.5869751	0.56
280.2190552	0.13
281.2095642	0.46
284.8345642	0.31
286.2478638	0.33
288.3990784	0.17
290.7306824	1.23
291.3673706	3.13
292.3946533	0.11
295.0334167	2.80
295.7940979	0.28
296.5768127	0.11
297.3207397	0.12
298.2483521	0.24
299.0135193	0.11
300.0857544	0.79
302.8720398	0.37
304.1456909	0.15
305.9588013	0.40
308.3190613	23.38
309.2841187	1.01
313.3831787	1.15
314.2935181	0.50
321.9716187	0.28
323.2846985	0.21
324.2723999	0.12
325.4785461	20.13
326.3073425	100.00
327.1723328	7.07
329.4377747	0.19
330.9674072	0.11
332.6326904	0.20
334.9892578	0.60
338.4602966	0.09
343.5852661	0.46
354.0600281	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	265.015
Annotation	Unknow
Peak:m/z	Relative Intensity
219.0839539	0.03
221.1517334	0.09
223.9202728	100.00
237.1440887	0.03
241.1970062	2.30
241.8494415	20.21
243.0192871	0.03
243.9372559	0.12
255.7901459	0.05
264.7992554	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	680.2075
Annotation	Unknow
Peak:m/z	Relative Intensity
221.2556000	0.09
233.3408813	0.04
251.1451111	0.07
281.1917419	0.11
287.1432190	0.07
323.2814941	1.12
327.3081665	0.05
336.1596680	0.03
337.2161865	0.44
341.1840820	0.53
342.5546265	0.15
355.0789185	0.02
373.1185913	0.06
373.7598267	0.01
383.2516479	0.07
395.0169678	0.02
397.4918823	0.08
446.5629883	0.03
462.2727661	0.10
464.7662354	0.07
483.1871948	0.03
486.1484375	0.02
502.0159912	0.30
503.2979736	100.00
504.0543213	0.29
505.2116089	0.04
517.7238159	0.01
529.2885132	0.02
541.7282715	0.04
545.2744141	0.02
560.6287231	0.03
582.4981079	0.04
590.1547241	0.10
615.1752319	0.01
622.3400879	0.03
633.9915771	0.01
639.2893677	0.41
661.7100220	0.03
663.4494629	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	590.4979
Annotation	Unknow
Peak:m/z	Relative Intensity
171.3860168	0.64
192.0771637	0.29
194.0806580	0.33
207.1446838	0.62
219.0081482	0.14
227.0017090	1.63
232.2831116	0.27
248.9164429	0.68
254.5354309	0.20
259.3782349	0.56
263.5100708	1.85
271.3851624	0.45
277.3295288	0.68
288.0859985	0.60
289.2440186	4.42
299.0507202	1.19
301.8106079	0.30
306.3391724	7.44
309.8457336	0.27
314.1868896	0.35
324.2895508	52.62
331.8009033	0.11
342.2335205	69.86
342.8620605	0.95
430.6248169	0.20
532.0114136	0.44
537.2777710	0.11
554.5941162	0.37
558.1439209	0.93
572.3350220	100.00
573.7493286	1.46
581.5537720	0.71
589.5266113	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	408.212
Annotation	Unknow
Peak:m/z	Relative Intensity
119.8775406	1.67
130.9471588	0.11
132.0191650	0.07
133.0468750	0.33
135.0430908	0.12
137.1012268	0.09
137.9612122	0.21
140.9240417	0.41
146.0008240	0.13
147.0745239	0.09
148.2928772	0.08
161.2349091	0.06
166.0090790	2.70
167.0014496	0.15
182.0951538	0.08
189.0901031	0.08
190.9419861	0.11
193.8478088	0.07
195.1191864	0.10
205.5634155	0.10
209.2394562	0.43
212.2268524	0.11
215.1067657	0.19
216.0918274	0.11
217.3370972	0.21
233.1962585	0.22
234.9076538	0.06
238.7582092	0.15
242.9550171	1.10
246.2019348	0.19
249.1210938	0.12
250.4491577	0.13
257.1441650	0.18
259.0971375	0.81
261.6050415	0.08
264.3914795	0.07
267.0564270	0.38
268.2072754	0.06
270.9453735	0.09
277.2194519	9.22
279.2519531	100.00
281.3195496	0.11
282.1647949	0.06
284.6204224	0.30
291.1909790	0.05
295.3652039	0.19
301.3246765	0.23
302.6755981	0.06
305.3740845	0.09
306.2102661	0.06
309.1244812	0.13
316.1248779	0.45
318.1233521	0.10
319.6088257	0.19
323.1924438	0.07
325.2937927	0.42
326.2025452	0.42
327.0072632	0.14
334.3120728	0.04
335.6520386	0.16
337.1869812	0.14
339.3565369	0.27
344.0740662	0.33
345.3849792	0.23
346.9348450	0.39
349.0205994	0.19
349.7357178	0.34
358.7242737	0.20
362.2969360	0.27
363.2742004	0.36
364.2443542	0.44
367.3625183	0.15
372.2895508	0.59
372.9115295	0.32
377.4352722	0.27
379.2495728	0.27
381.3106995	0.23
385.2428589	0.48
387.3230896	0.12
388.9955139	0.69
390.2867737	13.10
391.1898499	1.42
394.2047424	0.20
398.8117676	0.16
407.6932678	0.13
408.5740051	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	206.89
Annotation	Unknow
Peak:m/z	Relative Intensity
122.7963409	100.00
151.0041962	0.03
214.6376953	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	428.11
Annotation	Unknow
Peak:m/z	Relative Intensity
129.8241272	0.12
130.9678345	0.28
133.1997528	0.16
138.9850311	0.16
143.1707611	0.16
145.0201874	0.32
147.9500580	2.03
165.9826355	0.19
169.9920959	0.10
171.1518707	0.18
174.1548767	0.12
179.0909729	0.28
185.0473022	4.92
186.1789856	0.68
190.7483215	0.08
196.0426025	1.80
202.0812683	0.96
203.0196991	1.26
208.9849701	1.41
213.2659912	0.45
215.1914062	0.39
216.9114380	0.11
219.0805664	21.30
219.6872101	0.17
221.0765686	0.79
231.1846924	0.10
241.2982483	0.19
245.1642761	1.01
249.0645142	6.72
250.5469971	0.20
251.2793274	0.63
253.0691833	0.25
267.1017761	2.83
268.2474060	0.12
269.2668762	0.58
276.4223022	0.12
282.9326477	0.21
285.2979431	0.85
288.2817383	0.15
293.1308899	0.08
296.8665771	0.77
299.0463562	100.00
300.5921021	0.31
303.2167358	0.30
306.1760864	0.26
312.5018616	0.13
313.1481323	0.07
315.1450500	5.57
316.0856323	0.44
321.2798462	0.80
324.3658752	0.29
325.0749512	0.07
330.4002380	0.17
338.0649109	3.73
339.2096558	13.74
348.1685181	9.47
349.3898315	0.36
353.0888977	6.01
354.5975342	0.10
356.9637756	0.13
365.7530212	0.12
366.5223083	0.14
371.1351624	0.10
371.8049927	0.12
374.7286987	0.21
378.2190857	3.25
381.6910400	0.53
383.3478699	0.08
387.6007690	0.08
392.2912292	0.17
396.2821960	2.52
397.0938416	0.50
406.1327209	0.23
409.8869934	2.44
410.9124756	0.46
411.5821228	0.16
418.9157410	1.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	659.26
Annotation	Unknow
Peak:m/z	Relative Intensity
191.8948822	0.72
196.0818481	0.44
213.0206451	1.41
251.0526123	0.42
310.8904419	3.32
349.2231445	1.84
387.2555542	0.35
425.1441040	0.21
446.8935547	0.34
463.2928467	0.58
485.0543213	100.00
492.0615234	0.52
571.7268677	2.49
572.8245239	0.29
574.7094116	0.26
575.3444214	0.19
581.1314087	6.84
582.1260986	0.54
584.1261597	1.39
586.1613770	0.38
599.2169189	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	343.1227
Annotation	Lactulose
Peak:m/z	Relative Intensity
126.5105896	0.38
127.1516724	0.20
144.7695465	2.61
162.9304810	3.41
177.7128906	0.55
180.1210785	5.68
181.0980530	1.36
195.1869202	0.18
208.4598389	0.16
216.9945374	0.78
252.9330139	1.42
258.7648315	3.08
259.6268311	0.26
271.1915894	5.78
272.2549438	3.25
281.1156006	0.75
284.4493408	0.73
288.9141846	15.15
289.8442993	8.85
306.8469543	2.25
308.0800171	0.83
323.1305542	0.45
324.9732361	100.00
326.0161743	19.99
326.6246338	0.70
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
90.91227722	0.43
93.06340027	0.27
96.99022675	0.40
106.9959335	0.23
109.0965118	0.96
111.1580505	0.79
112.6678619	0.97
118.8325958	0.29
121.0407181	1.14
123.1694412	0.19
125.0461426	1.19
126.8516083	0.30
128.9503784	1.10
130.5628052	0.38
133.0769501	1.06
134.315567	0.66
135.1952057	0.19
136.9866943	0.42
139.0285645	0.44
141.0671997	0.30
142.908905	0.24
144.9682312	1.00
146.8866577	1.27
149.196106	0.38
151.1899719	0.95
153.1204376	1.30
154.8088379	1.84
156.2518921	0.79
157.0343933	0.43
159.3811646	0.36
161.3818817	0.31
165.0795593	0.26
169.0015564	0.33
171.3162842	0.21
172.0320282	0.65
174.802124	0.34
177.2020569	2.00
178.9777527	0.79
181.0656738	1.93
183.0614166	2.25
185.3306274	0.34
186.5438385	0.59
191.0149231	0.93
193.2088318	0.50
195.1270599	2.57
197.1341553	2.44
198.305069	1.07
199.1811981	0.90
205.3146667	0.82
206.962677	1.54
208.1719971	0.34
209.1997681	2.52
210.6158447	2.44
211.4117126	2.19
212.1107178	0.17
213.2881775	2.03
218.9529419	3.41
220.9853516	0.79
224.6455688	1.47
225.3504944	0.54
227.1888733	0.88
228.2964478	0.70
229.2671204	0.17
233.4585266	0.54
234.1654968	0.35
235.2810669	3.05
237.2353516	4.42
239.2255249	0.58
241.0091553	0.98
243.1756287	0.16
246.2240295	0.23
247.1296997	0.47
248.2686768	0.28
249.2856445	1.45
250.6677856	1.45
251.3121338	2.51
252.6817627	2.06
253.3807678	4.30
255.1357422	1.62
257.1952515	0.92
260.053833	0.39
265.2688904	2.11
267.1480713	2.60
267.9945679	0.37
269.6091919	2.05
270.4400635	0.82
275.2902832	17.85
276.3070679	0.98
281.3895874	0.23
282.328125	0.81
283.2741089	6.74
284.8830566	0.38
293.2147827	100.00
293.8935547	2.04
297.3634949	0.38
302.0237732	0.58
305.0576172	0.64
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	311.2211
Annotation	trans-EKODE-(E)-Ib
Peak:m/z	Relative Intensity
97.14545441	0.52
109.0051193	1.04
117.1053314	0.52
121.1265259	0.83
125.163826	1.00
135.1326447	1.23
142.8820496	2.21
149.2284546	2.64
153.1882629	0.90
159.2953796	0.62
177.1659546	2.46
181.1230469	0.98
185.3008423	0.57
191.1062317	3.68
195.1244812	2.54
197.2961121	0.65
199.1762848	2.05
206.1170654	1.92
211.303833	2.24
213.1315613	1.74
217.1231079	1.74
221.1394043	2.11
226.4050598	2.07
227.2008972	0.52
234.2017517	2.31
236.3385315	0.52
239.48349	1.22
241.0973816	2.03
251.2506714	1.51
253.0220032	6.97
255.0991821	1.43
265.2608643	6.70
267.2992554	0.66
268.0455627	0.55
270.1060791	2.38
275.2619629	18.12
283.3311157	4.42
293.21521	100.00
294.142395	2.26
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
107.3188477	0.08
109.0835037	0.51
111.8473969	0.28
115.1331329	0.26
118.6889648	0.11
120.9576721	0.17
122.0159912	0.11
123.1005096	0.25
125.1955795	0.09
131.9767761	0.17
133.0861511	0.58
134.0717926	0.10
135.1766968	0.26
136.0249329	0.44
137.0278473	0.33
143.2040405	0.71
146.9127197	0.37
148.0819092	0.55
148.9528809	0.66
150.3385315	0.61
155.1377563	0.08
157.1437683	0.55
158.2138062	0.22
162.2052917	0.13
163.2291565	0.41
164.0036621	0.17
167.0427856	0.38
169.2377625	0.41
170.170929	1.04
175.0800323	0.63
176.0948486	0.79
177.9768066	0.09
180.0886536	0.47
183.235733	0.15
184.130127	0.57
187.2922668	0.32
188.8500977	0.12
191.1270905	0.62
193.0672607	0.38
194.0053406	0.14
201.2950287	0.17
204.193634	0.20
206.014801	0.15
210.145874	0.25
211.1453247	0.11
212.2946777	0.50
217.1252136	0.21
218.0375366	1.35
218.9837952	0.37
223.3879395	0.43
227.2673035	0.44
229.1257019	0.25
231.1775208	1.08
232.0563965	0.22
234.3237	0.07
236.7095337	0.53
239.2142944	0.31
242.1703186	0.46
243.0409546	0.33
245.3786011	0.72
246.196991	0.21
247.1734009	2.58
248.333374	2.87
253.3876343	0.20
254.4149475	0.90
255.248291	0.21
256.3453369	0.08
257.197876	0.58
257.9863892	0.21
261.2935791	0.64
263.3967285	2.15
264.0628662	0.13
265.1720276	0.14
268.0872192	0.35
269.8862915	0.19
271.3560181	1.35
272.3008118	0.16
275.1598511	0.61
277.557251	0.77
283.392395	0.73
284.4465942	0.27
288.1254883	0.22
289.1862488	12.76
293.2227783	5.54
294.9914246	0.27
296.4414673	0.71
297.3434143	0.80
299.3796997	0.31
300.8300476	0.43
304.4846191	0.21
305.3966064	1.20
306.301239	13.44
307.1463623	4.54
311.113739	1.85
313.4564819	0.25
321.9043579	1.14
323.495636	21.91
324.2931824	100.00
325.1114502	2.71
327.0238037	0.32
332.8478394	0.58
333.6948853	0.09
340.5238647	0.15
341.7314758	0.51
342.4172058	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	558.1046
Annotation	Unknow
Peak:m/z	Relative Intensity
162.8951874	0.06
171.0641327	0.02
174.9940643	0.50
176.0274811	0.05
202.9403687	0.08
209.0784912	1.87
209.9945221	0.39
211.3763885	0.03
217.7879333	0.03
229.5320129	0.02
231.0837097	0.06
236.0052490	0.13
251.3020935	0.05
252.1277618	0.07
255.2236328	0.07
256.0877075	0.08
257.2586060	0.07
259.4099121	0.07
274.2866211	0.02
275.2562256	0.07
279.8837280	0.02
282.0467529	0.08
283.0689087	0.05
289.2589722	0.12
306.2791138	0.06
309.3035278	0.05
313.0682373	0.14
321.1256714	1.87
321.9887085	0.17
322.6209717	0.03
324.3440552	0.08
325.9935913	0.67
326.8933716	0.30
329.5418091	0.02
336.1469116	0.05
339.1196899	25.28
340.2174072	5.54
341.1407471	0.05
343.3764038	0.06
344.2617188	0.08
348.7661133	0.03
375.1248779	0.11
381.3005981	0.06
382.5901489	0.02
391.0258179	0.04
393.2045288	6.09
394.3185425	1.56
396.8549194	0.05
411.3617554	0.37
412.2858887	0.17
421.2488403	0.11
424.2687988	0.03
427.1091919	0.16
429.1165771	50.18
430.0980225	8.36
430.7539062	0.03
438.6599121	0.05
440.2642822	0.05
443.2175293	0.14
450.3623047	2.55
451.1685181	1.35
459.0676880	0.04
464.4426270	0.04
468.1878662	100.00
469.1668091	20.98
470.1865234	0.28
474.5739136	0.03
483.1168823	8.34
484.2239990	1.92
489.4651489	0.05
493.3497925	0.06
494.9822998	0.27
496.1671753	0.30
500.1453247	0.15
511.2686768	0.06
515.2958374	0.11
516.8344116	0.12
527.5048218	0.14
535.7091675	0.03
537.0473022	0.14
540.1632690	1.87
541.0541382	1.20
541.9519043	0.18
544.5758667	0.10
549.7735596	0.03
550.8040771	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	556.36
Annotation	Unknow
Peak:m/z	Relative Intensity
161.8767242	0.08
164.0567169	0.44
172.0503387	0.18
174.4056854	0.04
180.0425110	0.22
192.1320801	0.84
208.1986694	0.07
210.0530090	0.07
220.1474609	0.05
226.0064240	3.31
228.7684326	0.22
230.0749054	1.08
238.1550903	12.68
247.0507812	0.65
248.1461029	2.18
256.1112366	8.47
259.5433350	0.14
265.1643677	29.16
274.0406799	57.77
283.3442993	0.12
331.2501221	0.22
357.0152588	0.02
373.1766357	0.13
375.0098267	0.57
377.3035889	0.12
391.3018188	0.18
394.2047119	0.67
406.1416626	0.04
427.4386597	0.09
428.6363525	0.19
460.3314209	0.12
463.1469116	0.19
472.2218018	23.99
481.1176758	0.08
484.0253296	0.12
502.2677002	9.78
520.1755981	12.35
520.7949829	0.47
538.2308350	100.00
538.8922729	0.57
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	551.1833
Annotation	Unknow
Peak:m/z	Relative Intensity
158.9552612	0.23
190.7867584	0.20
209.0436401	100.00
300.8215332	0.07
303.3136597	0.05
306.2688599	0.04
324.2853394	0.10
328.8318481	0.05
341.2983398	0.15
342.2777710	0.13
343.1970215	0.12
370.1445923	0.09
371.1455688	0.06
377.2012329	0.60
389.0678101	0.11
414.3487549	0.09
452.2933960	0.06
503.3265991	4.20
504.3236694	42.74
505.2872925	15.47
505.8983765	0.09
532.7398071	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	468.0935
Annotation	Tuberosinone N-beta-D-glucoside
Peak:m/z	Relative Intensity
143.0161743	0.18
168.8759155	0.05
179.0703430	0.06
197.2335510	0.08
208.9920197	0.11
233.4231720	0.05
249.0489197	0.26
254.1765442	0.45
261.0572205	0.05
263.1929626	0.05
272.2034302	7.04
288.3276062	0.32
291.1023560	0.16
304.1819763	2.52
305.1997070	0.95
306.2830811	7.06
320.1452026	0.05
323.1600647	0.06
338.0904846	100.00
353.5541382	0.10
360.3493958	0.14
362.1913757	0.06
377.0045471	0.05
378.1221313	8.85
380.1232605	0.02
388.4991760	0.08
393.8373413	0.09
407.3974915	0.04
413.0684814	0.03
422.1591797	0.09
424.2919617	0.10
425.2246399	0.08
447.0377502	0.08
449.5143738	0.02
450.2737427	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	640.04
Annotation	ADPribose 2'-phosphate
Peak:m/z	Relative Intensity
201.7833252	0.45
219.2661133	0.31
250.7985535	0.55
254.7584229	0.17
260.0508118	0.18
283.9951782	1.28
291.9891357	0.14
303.1639404	0.60
307.1847534	0.45
315.9551392	0.16
316.8954468	0.29
322.3945923	0.26
323.9821777	0.32
339.1792603	1.34
341.1837158	0.54
342.8504639	0.14
348.2665405	4.83
349.1100464	0.67
356.2442627	0.51
365.3905029	0.25
371.1303711	0.28
371.9451904	0.23
380.1597900	0.52
380.8522339	0.53
382.8664551	0.21
395.2805176	0.59
396.9583130	0.34
410.7705688	0.17
413.1411743	39.17
414.3751221	1.46
419.0939941	0.30
425.3070679	0.15
443.9971313	0.84
445.3021240	1.10
452.0756836	0.10
454.0559692	1.79
462.1655273	0.13
469.4973755	0.33
470.3415527	0.86
484.1266479	0.96
492.3259888	1.33
493.1256714	1.64
502.8593750	0.27
505.3637085	0.30
508.1195679	0.20
510.1062622	1.99
511.0012207	2.12
518.2771606	0.45
533.3806763	0.50
535.6953125	0.24
537.1656494	0.26
560.0460815	0.33
562.5903320	0.13
564.1069946	0.74
568.4185791	0.43
595.1824951	0.22
601.5465088	0.11
621.9476929	100.00
622.7775269	2.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1030.431
Annotation	Unknow
Peak:m/z	Relative Intensity
635.8170166	0.27
917.2581787	0.14
1178.7813720	2.67
1450.4747310	0.17
1576.0166020	1.93
1697.0228270	0.14
1724.7502440	0.33
1727.8438720	0.50
1730.8289790	0.17
1765.8985600	0.31
1782.2346190	0.26
1789.7757570	7.73
1796.9725340	11.82
1799.4405520	0.89
1813.7415770	0.36
1817.2281490	0.14
1829.9353030	0.96
1831.1671140	0.27
1832.3411870	0.33
1836.3747560	0.37
1837.7213130	0.15
1841.8249510	0.73
1844.7125240	0.40
1851.3104250	0.43
1853.4963380	0.12
1854.3079830	0.12
1855.8137210	0.44
1861.1732180	0.31
1863.5925290	0.22
1866.3856200	0.95
1867.1932370	2.30
1879.9862060	0.64
1883.3405760	0.66
1883.9815670	0.17
1886.1099850	0.16
1891.1624760	1.78
1891.7922360	0.17
1893.4642330	0.23
1897.5529790	0.25
1899.6745610	0.48
1901.8557130	0.69
1903.8576660	44.31
1908.8328860	1.02
1909.9820560	1.20
1911.9592290	8.48
1912.7972410	0.26
1914.5233150	2.13
1917.8892820	3.15
1918.7731930	6.13
1920.1046140	1.12
1922.8493650	0.58
1926.0208740	0.62
1927.6888430	0.13
1928.3653560	0.47
1930.8142090	26.57
1931.4940190	1.45
1934.3541260	0.39
1936.6903080	28.98
1938.2855220	0.28
1939.5643310	2.89
1940.3933110	0.45
1943.4338380	3.00
1944.1236570	0.30
1945.7030030	0.53
1946.8282470	0.66
1949.3497310	0.47
1950.1842040	0.29
1951.0793460	0.44
1953.6356200	0.30
1954.7673340	18.33
1956.0584720	1.71
1958.1854250	1.14
1958.8905030	0.91
1961.1940920	0.31
1962.4470210	0.17
1964.9212650	3.30
1967.3615720	0.35
1968.6120610	0.27
1970.9525150	1.05
1972.4737550	0.52
1974.4650880	0.37
1976.5135500	12.31
1978.1433110	0.48
1980.1937260	0.81
1981.0272220	2.31
1982.1876220	1.95
1983.8903810	21.32
1984.5865480	0.38
1985.5118410	0.26
1986.6180420	20.38
1988.0347900	100.00
1989.4318850	14.23
1990.6403810	0.32
1991.8797610	0.99
1993.4625240	3.04
1994.3303220	0.27
1995.0511470	0.12
1996.4412840	1.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	484.17
Annotation	Unknow
Peak:m/z	Relative Intensity
149.0494080	0.35
161.9300537	0.78
173.1338806	0.25
181.1321106	0.65
231.8587646	0.16
232.9417114	0.49
233.9443054	0.65
240.0494537	0.93
283.1192322	0.25
287.3551636	0.20
296.4658203	0.33
310.2710571	0.14
319.1874695	11.80
320.1063843	10.14
325.0639954	0.19
337.2400513	1.00
338.1323242	11.56
339.4642639	0.50
355.2657776	100.00
356.2858276	0.26
368.3327637	0.32
386.9391174	0.31
424.7792664	0.79
428.4106140	0.35
437.8162231	0.17
440.7723999	0.97
452.3231506	0.67
466.1036072	5.76
467.2535095	0.34
476.5503845	0.63
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	807.2347
Annotation	Unknow
Peak:m/z	Relative Intensity
227.3887634	0.09
243.0707092	0.09
249.0478210	0.07
255.3286133	0.76
257.2625427	0.21
258.3029785	0.08
271.0858154	1.25
273.0095215	0.05
283.2532959	0.06
298.9455261	0.16
300.1027222	4.27
301.1184387	46.35
302.1131592	5.44
306.1608887	0.10
313.3824768	0.19
343.3352966	1.62
361.0516357	0.05
391.9046021	0.06
409.1131592	0.12
445.0545654	0.15
463.2275391	100.00
464.2553711	18.94
579.5277100	0.10
603.2954712	0.04
614.7083130	0.28
627.4076538	0.15
628.3837280	0.15
645.2629395	42.82
646.3506470	6.76
682.0905151	0.27
687.3563843	1.58
688.2883911	0.59
701.6187134	0.04
714.2800293	0.10
717.3151855	0.03
730.3614502	0.15
743.2106323	0.09
747.5308228	0.06
762.0275879	0.25
766.8622437	0.09
772.2596436	0.06
789.4673462	0.09
798.3665771	0.73
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	307.0826
Annotation	Oxidized glutathione
Peak:m/z	Relative Intensity
101.7899017	0.18
124.9423218	0.09
129.9335938	59.19
130.9342957	2.10
144.0228577	0.36
157.1389465	0.33
161.9880219	0.31
175.0500488	0.18
177.0416565	1.08
179.0693359	0.68
179.8407898	0.21
189.0451355	0.46
199.1087952	0.17
204.9103394	0.37
208.8155823	0.60
211.0197754	0.12
216.9026184	0.29
218.6296082	0.24
224.2992249	0.10
231.0879211	1.88
233.1079407	0.13
234.0496216	0.61
234.9339905	0.98
242.7333984	27.29
243.6530151	0.14
244.5413208	0.44
246.7158813	2.29
257.3816528	0.31
260.6160278	3.86
261.4335938	0.11
265.4352417	0.42
269.6361084	30.03
270.3990173	1.53
274.2617493	0.10
275.6122437	38.52
276.2608032	6.57
276.9790344	0.87
278.0724487	0.10
279.1099854	0.21
280.0753174	0.86
289.2001953	2.50
290.3009033	0.96
293.2944336	0.17
298.6202698	100.00
299.2428589	13.70
339.4449463	0.17
340.0866394	0.64
346.0379944	0.20
355.1652222	86.73
356.1112976	7.79
361.2929688	0.13
362.8964539	0.19
364.1775818	0.88
380.4161072	0.57
381.1105652	6.99
382.0115662	0.22
391.1127625	0.30
409.2616272	14.24
410.3371887	0.74
414.9095154	0.27
421.3412476	1.12
466.4349670	3.79
467.2065735	1.38
468.3325500	0.14
475.3239136	0.09
484.1983948	73.41
485.3417358	5.85
520.2990723	1.81
538.2764282	12.27
539.3792725	1.11
550.1032715	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	302.3048
Annotation	Sphinganine
Peak:m/z	Relative Intensity
95.02477264	0.07
97.01509094	0.13
105.2403717	0.06
108.7597504	0.18
111.7365341	0.06
123.0212708	0.39
125.1371918	0.08
137.0284271	0.22
139.1332703	0.08
151.1550903	0.08
155.9860535	0.06
162.1930084	0.08
165.1435394	0.03
179.2402954	0.11
192.2796783	0.06
193.4039612	0.05
194.3088379	0.04
206.2492676	0.04
211.4225464	0.12
213.8508606	0.03
215.9367371	0.15
225.3031006	0.02
227.2591858	0.08
232.3728027	0.03
240.4448547	0.99
245.1211853	0.03
249.479248	0.25
250.6735229	0.13
253.1715088	0.19
254.3796082	0.41
255.8770142	0.17
258.300415	0.05
259.4418335	0.16
260.1704407	0.13
260.8525391	0.09
266.3470764	3.28
267.260437	0.84
270.0760498	0.31
271.0620422	0.17
274.2457886	0.09
274.9239197	0.06
284.2894592	100.00
285.0242615	0.87
292.8977661	0.20
293.8348389	0.17
302.2683105	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	551.1766
Annotation	Lactucaside
Peak:m/z	Relative Intensity
164.9796753	0.42
165.9879608	0.19
177.9317627	1.38
179.2111053	0.07
193.0896606	13.95
194.0268555	1.59
195.0061951	2.48
196.1854248	0.51
207.1480103	0.18
217.0450287	0.13
233.0833893	0.02
235.3278046	0.05
236.1778870	0.06
265.3579712	0.18
267.0364990	0.03
278.0191650	0.08
285.1303101	0.06
304.2412720	0.03
309.2827454	0.10
326.4052734	0.06
336.9711914	0.03
341.2050171	12.49
342.2261963	3.22
355.2167969	0.09
370.4490967	0.21
371.3472290	0.64
372.4705811	0.05
384.2894287	0.10
389.1445312	100.00
390.1685791	17.04
403.2382812	0.08
422.2528687	0.08
429.5446777	0.09
431.3164673	0.81
432.3878174	0.03
437.2898560	0.03
443.2883911	0.03
445.4834595	0.04
447.7994385	0.03
449.3194580	0.06
455.1514893	0.12
461.0382080	0.05
462.4280396	0.10
491.0619507	0.87
492.1727905	0.27
505.2909546	0.49
506.2728882	0.29
508.6319580	0.05
516.6894531	0.06
532.3527222	0.03
533.5618286	0.33
534.1853638	0.23
537.3505249	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	641.1553
Annotation	Unknow
Peak:m/z	Relative Intensity
183.7512512	0.07
200.0708466	0.16
207.8581543	0.03
208.9915314	0.55
210.1815186	0.04
212.0643463	0.03
219.1821594	0.05
228.1034088	0.07
237.9062805	0.05
254.0936890	0.10
255.0384064	1.82
263.9953613	0.03
266.0826416	0.67
267.0599060	0.12
272.4118042	0.05
273.0181274	0.10
274.1712646	4.73
286.2192383	0.16
294.5867310	0.04
301.1307373	0.15
302.2456055	1.99
303.1903076	0.42
304.3261108	0.17
306.1975098	0.24
307.1464233	0.11
310.0455322	5.27
311.0485229	1.25
312.1559448	0.72
330.2750244	0.16
331.1299438	0.03
339.4172363	0.06
345.1372070	1.47
346.1214600	9.58
347.1658936	100.00
348.2427368	3.56
349.1920166	0.11
361.5212402	0.03
369.3651123	0.04
378.2791748	0.86
379.0888062	0.11
380.1752930	0.11
382.2736816	0.16
383.1095581	0.17
384.1340942	0.35
385.1149902	0.12
388.1677246	0.91
389.1398315	0.32
390.1757202	0.12
391.2993774	0.05
394.9832764	0.05
411.4713135	0.05
413.0340576	1.04
414.2205811	0.53
415.1065674	0.19
415.8802490	0.03
424.2442017	0.14
425.1226196	0.28
426.2888184	0.12
431.1974487	0.69
432.1710815	0.07
437.4656982	0.04
449.1918335	0.38
450.1761475	0.73
450.8646240	0.06
457.1311035	0.45
458.1748657	0.08
467.1079712	0.95
468.2937622	0.70
473.2611084	0.09
475.1085815	8.65
476.2514038	3.10
479.7002563	0.12
493.4110107	0.09
501.4542236	0.03
509.2274780	0.40
511.1019897	4.27
512.2506104	0.91
516.2396240	0.06
519.4506226	0.10
534.1906738	0.22
535.0186157	0.07
552.3546753	0.07
553.1605835	0.60
560.3526611	0.02
578.2266235	3.17
579.2570190	1.27
585.6209717	0.13
596.2139893	0.55
596.9836426	0.13
604.1890869	0.25
605.2914429	0.10
617.7464600	0.13
622.1943970	6.74
623.2099609	6.87
623.8427124	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	367.15
Annotation	Tetrahydropentoxyline
Peak:m/z	Relative Intensity
166.3046875	0.30
167.0053101	0.16
175.2504272	0.22
193.0581055	0.14
203.8918915	0.13
205.2248535	0.28
227.6231689	0.10
229.1414185	8.36
235.2726135	1.05
237.2975159	0.37
253.3011780	0.12
259.3588257	0.45
261.9105225	0.53
270.4357910	0.63
271.1639404	4.11
276.9672546	1.53
296.2827148	0.29
304.2808228	0.13
306.7561340	0.16
309.0942688	0.09
313.0639038	0.40
314.3352661	0.13
318.9592896	0.17
320.7226868	1.22
325.0075684	0.14
331.2104187	12.74
332.2914734	0.13
343.9457092	0.42
349.1652527	100.00
349.8721008	0.51
358.3110352	0.52
373.2373962	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	332.1333
Annotation	5'-O-beta-D-Glucosylpyridoxine
Peak:m/z	Relative Intensity
106.0523376	0.02
107.9989319	1.44
123.1161499	0.02
124.0264740	0.21
124.9929657	0.05
127.1054382	0.08
134.0780640	0.48
135.9061584	1.69
144.7453613	0.02
147.2726593	0.02
148.0682373	0.03
150.1260071	0.01
151.9658966	6.35
152.5900574	0.04
154.1036377	0.33
164.0395813	0.05
170.0169220	6.92
186.2220764	0.04
196.0287018	0.05
202.2681427	0.06
212.1009216	0.01
216.3606873	0.05
230.1851501	0.04
278.2375488	0.03
280.9467773	0.01
296.2583618	0.16
314.2152405	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	534.1052
Annotation	Unknow
Peak:m/z	Relative Intensity
170.0693665	1.05
171.2113647	0.53
177.0901947	0.57
183.4851990	0.34
187.1032257	0.41
188.1520996	2.72
195.0607300	0.76
199.1588287	0.25
201.9480286	1.38
211.0332642	2.03
219.1307220	16.96
225.1665344	0.19
226.8036499	0.99
233.9337769	0.43
245.3708496	0.30
251.0405579	37.32
253.1754761	0.21
267.0903931	0.19
268.4709778	0.11
292.0583496	0.14
293.1627808	0.75
298.5598755	0.33
299.4011841	0.22
302.2196655	0.88
303.8993835	0.13
305.2117310	2.26
306.2427979	0.46
309.2664795	0.25
315.0805664	0.80
320.0707397	1.00
322.6953125	0.32
325.0674438	0.90
328.8790283	0.12
330.2250977	1.26
335.2447510	0.25
338.0060425	0.57
339.1230469	1.91
348.2676392	11.10
353.5190430	0.39
354.8732910	0.42
356.0770874	0.94
363.0841064	0.56
371.0534668	1.25
372.2191772	0.22
372.8673096	0.59
378.2070312	0.67
380.0836792	44.84
387.3171387	0.34
388.1407471	0.62
390.9710693	0.21
396.2269897	2.88
397.1831055	0.66
400.5292969	1.27
402.7976685	1.03
405.1113892	100.00
412.2488403	0.47
422.4019775	0.55
426.8997192	0.20
428.2148438	0.82
431.1028442	0.17
439.3270264	0.24
441.2962036	0.53
443.7385254	2.55
445.0895996	22.10
447.3147583	0.23
454.4029541	0.60
457.8521729	0.98
459.1292114	18.81
460.0001831	0.44
461.7933960	0.96
463.5606689	0.39
465.1381226	0.50
474.4352417	1.88
476.2879028	0.12
479.2946777	0.14
487.0623169	1.41
488.2144165	3.11
496.3587646	0.60
502.0197144	3.21
503.3416138	0.16
504.3650513	0.11
505.2138672	0.83
506.1423950	1.25
507.1469727	0.11
515.6507568	0.77
516.3925171	4.27
517.2439575	0.33
524.6418457	1.76
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	344.3149
Annotation	Unknow
Peak:m/z	Relative Intensity
104.8977814	0.29
108.8799591	0.10
111.0041046	0.05
119.1363297	0.13
121.0379715	0.31
133.0751190	0.05
135.1992493	0.15
137.0043488	0.64
147.0827942	0.12
149.1461182	0.07
161.0297546	0.67
163.3182983	0.17
165.2568359	0.34
169.1752472	0.13
175.1588898	0.39
177.2182007	0.27
189.2088623	0.26
191.0470276	0.32
203.4351044	0.18
209.1337891	0.25
211.2256470	0.29
219.1463928	0.18
224.4724426	0.29
237.3627930	0.19
249.2601929	0.23
261.3171387	0.18
265.3324890	0.55
267.6136780	0.09
273.5758667	0.56
279.2666931	0.23
290.3870239	1.01
291.3082275	1.38
296.4269409	1.26
308.3344727	45.74
326.3358154	100.00
326.9409180	0.63
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	384.0341
Annotation	Discorhabdin G
Peak:m/z	Relative Intensity
163.0943909	0.37
203.1648865	0.65
204.6602325	0.30
209.2392273	0.70
221.2523193	0.27
221.9748840	0.76
233.0162659	1.22
234.0247498	3.91
239.5154419	0.62
249.2701111	1.06
251.3071289	1.00
251.9250793	0.79
264.0997314	7.14
267.1580200	2.58
277.9725342	1.24
282.7080078	0.76
292.0838318	0.82
293.0056763	0.66
294.1194153	19.35
302.4889526	0.67
303.9657898	26.02
306.0628662	0.47
324.0923157	36.86
337.7893677	0.79
339.9658813	0.56
348.1372986	1.15
366.0809631	100.00
366.8475647	0.39
374.3518982	4.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	639.1556
Annotation	Nervilifordin C
Peak:m/z	Relative Intensity
183.1078491	0.06
189.2574158	0.01
193.0688782	0.03
195.9264526	0.06
199.5659485	0.01
201.6485901	0.19
205.2749786	0.04
207.0515747	0.04
214.2704926	0.05
218.9822235	0.04
227.1520996	0.16
228.1840668	0.06
229.3772278	0.17
231.0409851	0.02
233.3621216	0.03
235.0537262	0.06
239.3948669	0.06
240.2232361	0.08
241.0087891	0.06
242.1200562	0.40
243.2729340	0.15
245.0131531	0.28
247.1266479	0.14
249.3669281	0.05
253.2431030	0.03
254.1504059	0.06
255.1944885	0.78
255.9939117	0.03
257.2565613	0.16
259.1957397	0.20
261.3807373	0.07
262.8539429	0.11
267.5737610	0.03
269.0749512	0.12
270.0549927	0.59
271.1279297	1.20
272.1558228	0.42
273.0355225	0.27
275.1934814	0.01
279.0733643	0.04
282.0040283	0.15
282.6453247	0.08
284.0555725	0.36
285.2140198	0.92
285.9139099	0.09
287.1939697	0.80
287.9758301	0.05
295.2799072	0.12
296.1724243	0.02
297.2537842	0.09
298.1762085	0.35
299.2422485	0.87
300.2265015	7.57
301.2123413	0.20
303.0531616	0.05
305.0112610	0.04
305.8959351	0.07
307.2703857	0.13
311.2618408	0.10
313.1237183	19.53
314.3354492	8.27
315.1788940	100.00
316.1721802	0.47
322.4121704	0.07
323.0367432	0.13
325.1907349	0.37
326.2047424	0.09
327.2223511	0.51
328.3630981	1.17
329.1389160	1.68
330.0845032	0.08
333.1446838	0.05
337.1872559	0.11
339.0731812	0.04
339.9734497	0.06
341.0755005	0.12
343.1354980	0.02
351.2802734	0.02
356.2847900	1.40
357.2282104	5.24
358.2361450	0.06
366.2969971	0.08
367.3669434	0.21
369.3784180	0.03
371.1705933	0.02
381.2225952	0.10
382.0661621	0.02
386.1594238	0.09
387.1541748	0.59
393.4838257	0.02
399.2669678	0.07
409.3061523	0.23
411.5659790	0.03
414.5486450	0.04
423.2172241	0.15
431.0544434	0.08
433.3530273	0.11
435.4631958	0.05
441.5513306	0.07
445.1966553	0.05
447.5844727	0.02
449.2350464	0.28
459.4752808	0.18
461.3239136	0.07
462.2520752	0.08
473.5336914	0.08
476.2689209	27.19
477.2471924	50.51
478.2382812	0.61
491.2763062	0.50
499.6896973	0.03
517.2858276	0.03
519.3218384	6.82
520.2792358	0.02
521.2907715	0.08
542.0072021	0.15
548.8687134	0.05
549.4973145	1.11
580.6143188	0.10
585.2329102	0.03
611.3053589	8.19
612.3566284	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	478.03
Annotation	Unknow
Peak:m/z	Relative Intensity
217.3365631	0.46
225.1222534	0.56
227.0802307	1.70
241.1324310	0.42
247.0307922	0.71
255.2573853	2.09
262.8463135	1.45
267.3112183	0.37
272.3288879	1.19
313.4714355	0.76
314.3512268	0.40
317.1398621	0.60
348.9506836	1.13
355.9436646	0.63
370.0879211	0.57
373.4134827	1.43
381.2642517	0.79
388.1087036	100.00
415.8244934	0.63
422.4254761	0.46
424.4366150	0.85
447.0825806	1.21
459.0833435	4.11
460.1726074	1.47
461.4487915	0.37
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	447.0929
Annotation	Luteolin 5-glucoside
Peak:m/z	Relative Intensity
135.1602631	0.03
143.2208557	0.08
145.8955688	0.09
148.4040070	0.05
151.0046997	3.27
152.1188660	0.76
153.0523529	0.24
155.1395874	0.05
161.2434082	0.04
162.1148682	0.03
164.0710449	0.13
165.1310425	0.44
169.0237732	0.50
170.9762268	0.19
172.0250854	0.07
173.3102722	0.03
174.1959839	0.44
175.1478271	0.39
177.0428162	0.12
177.9094543	0.04
179.0140076	1.26
180.0587769	0.14
181.1658630	0.02
182.0571289	0.06
185.2155762	0.05
187.0979004	0.25
189.1452484	0.05
190.8260345	0.03
192.1008606	0.07
193.0731201	0.44
194.3232422	0.04
197.0193787	0.12
199.0749359	0.09
201.3043365	0.05
203.2333984	0.23
204.3795776	0.03
205.4825745	0.06
207.1329651	0.03
208.2575531	0.05
209.2084351	0.04
210.4733429	0.14
211.5175781	0.27
212.2668457	0.02
213.2650909	0.10
215.1724701	0.24
216.1504974	0.06
217.2055511	0.16
223.1713257	0.04
225.2387695	0.05
227.2114868	0.95
228.2166138	0.48
229.0832214	0.08
230.0947113	0.07
231.2053986	0.19
238.0216064	0.07
238.9754028	0.33
240.2286377	0.05
241.1497192	0.42
243.0221252	1.42
244.1530457	0.29
245.0259094	0.08
251.1455078	0.05
253.3102112	0.06
255.1523132	10.95
256.1188965	4.54
257.2153625	1.44
258.4320679	0.46
259.1248169	0.40
260.3805237	0.07
264.5000610	0.03
265.1993408	0.26
266.1925354	0.12
267.4549866	0.14
269.1084900	2.01
270.3842468	0.39
271.2161560	0.39
272.3880920	0.05
273.4053345	0.05
275.2556458	0.05
279.2440796	0.03
281.2365417	0.55
283.0922852	1.84
284.1454773	80.07
285.1480408	100.00
286.1941833	20.49
287.2944641	0.06
288.1303711	0.07
292.1764832	0.08
294.3726501	0.03
295.3421631	0.12
296.1233826	0.02
297.1309814	0.28
298.1537170	0.11
299.2104187	2.58
300.1907349	0.69
301.2925415	0.12
303.4138184	0.03
305.4554443	0.04
309.2951050	0.07
310.2233276	0.12
311.2245178	0.16
313.2957458	0.04
314.0694885	0.17
315.1762390	0.03
317.5836792	0.03
321.1997681	0.02
323.1994934	0.13
327.1611633	16.59
328.2272644	4.11
329.5101013	0.22
330.5463257	0.10
331.2950439	0.04
333.3665466	0.15
337.3388062	0.06
338.1149597	0.07
339.3464661	0.26
340.2069702	0.06
341.2896118	0.03
352.3004150	0.08
353.2274170	0.06
357.2490540	1.35
358.3304443	0.73
360.2471313	0.06
369.2712097	0.23
370.2464905	0.05
371.4102783	0.08
372.4566345	0.05
373.3243713	0.16
379.3692322	0.09
381.3556213	0.02
383.1404419	0.03
385.3688965	0.09
387.2201538	0.11
388.2236633	0.04
390.4635925	0.04
393.4852600	0.04
399.2294617	0.02
401.2353516	0.23
402.0707703	0.05
403.4095154	0.02
404.4403992	0.06
405.1214294	0.05
410.3720093	0.27
411.2588806	0.27
412.4291382	0.03
419.1225586	1.41
420.3938599	0.19
425.3311768	0.17
429.3909912	0.26
430.4688416	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	465.1013
Annotation	6-Hydroxytricetin 5-rhamnoside
Peak:m/z	Relative Intensity
146.9077148	0.04
264.1775208	0.11
285.1914062	0.10
303.1265869	100.00
304.1144714	0.06
334.2223816	0.05
345.0791626	0.51
355.4656372	0.11
373.8481445	0.10
374.4952087	0.03
379.2006531	0.12
381.0537109	0.18
381.8454895	0.13
399.2647400	0.27
411.3359375	0.10
419.4936218	0.03
420.5140686	0.09
423.6708679	0.09
429.1249695	0.21
447.1791077	1.96
450.2509155	0.02
456.5900574	0.12
464.6363831	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	502.0792
Annotation	Unknow
Peak:m/z	Relative Intensity
145.5969086	0.08
171.1730957	0.05
216.8807373	0.03
270.3790283	0.03
281.2239990	0.09
282.9377441	0.07
283.9865723	0.04
293.1571045	0.11
307.1690063	0.04
322.9579468	0.03
325.3780518	0.02
330.0684509	0.10
337.4810486	0.06
348.4104004	0.15
349.0471497	0.03
355.3227844	0.09
373.0195923	1.80
380.0355835	0.07
413.1791687	100.00
426.9577942	0.10
428.9197693	0.09
440.1593323	0.18
444.2548523	0.22
457.8234253	0.08
459.1507874	0.18
473.5666199	0.03
483.2197571	0.08
484.3263245	0.18
485.8164673	0.04
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
69.8164368	0.09
72.9043274	0.58
87.9840241	100.00
90.9314270	13.94
113.9394684	0.39
116.0149536	1.43
131.8657227	0.34
133.7832336	0.08
141.5449066	0.03
148.0980835	0.02
159.9689178	0.17
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
91.1272125	0.06
117.1686859	0.04
118.9439087	0.58
122.8344650	0.25
129.9624939	0.03
136.0077515	6.37
136.9099426	0.07
146.9728088	1.22
149.1757050	0.06
152.7513275	0.02
165.0132904	18.33
165.6295166	0.22
179.9907837	0.03
182.0200653	100.00
184.2881165	0.07
202.3171692	0.12
214.4163208	0.06
215.1327209	0.03
217.9948425	0.02
220.3896484	0.06
221.3519592	0.18
227.3356628	0.11
231.1404724	0.30
237.4622192	0.03
248.1716003	1.63
251.2439575	0.06
252.6381226	0.08
265.1959229	0.48
268.4107056	0.10
269.0584412	0.11
270.0641174	0.19
272.9717712	0.03
275.2348022	0.34
283.2216797	0.30
293.1389160	2.68
294.2154541	7.99
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	261.1437
Annotation	Leucyl-Glutamate
Peak:m/z	Relative Intensity
85.9918060	17.51
130.0342560	0.72
131.9614868	100.00
132.9996490	0.05
148.0584869	0.72
198.0049286	5.09
199.2823944	0.16
215.1102753	0.65
225.2198944	0.21
226.3142395	0.02
243.0687256	6.67
244.2007904	29.88
247.3387909	0.15
252.0916901	0.07
260.5232849	0.04
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
96.9110413	0.03
127.9800720	100.00
130.0497284	2.74
160.9966736	0.03
197.0066071	0.03
223.1832733	7.54
241.1322479	32.78
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	521.3276
Annotation	Unknow
Peak:m/z	Relative Intensity
156.1243896	0.51
173.1309204	59.98
216.7322693	0.15
218.4737244	0.06
292.0794067	0.24
307.3333130	0.44
309.0524292	0.54
325.4942017	0.17
333.4657593	0.38
347.1780396	100.00
366.3340454	0.99
373.4671631	0.11
374.1865234	0.08
375.3703613	0.44
383.0322876	0.35
392.8901367	0.09
502.0031128	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	454.1121
Annotation	Unknow
Peak:m/z	Relative Intensity
147.0308533	0.81
156.2975769	0.08
160.0116577	0.16
162.0034180	1.24
170.0276337	0.71
175.8886719	0.04
176.9344940	0.05
179.0631104	7.97
180.3301086	0.09
183.0737305	0.08
188.1499023	0.23
196.8549805	0.05
200.8293304	0.16
202.0425415	7.49
205.1819000	0.11
207.2504272	0.13
211.1484985	0.82
219.1683502	100.00
221.2507629	0.24
222.1023407	1.23
226.9667053	0.02
233.0813141	0.65
245.1874084	0.52
251.1138611	7.92
255.1553345	0.27
259.2849121	0.66
273.2207336	1.57
285.0040283	0.83
290.0192566	0.20
305.0806580	0.17
306.1167603	0.04
308.2113647	14.80
310.3146667	0.06
317.1996460	0.11
324.9596558	58.67
325.5907593	0.21
330.1777649	1.77
340.6215820	0.13
348.1546631	47.79
348.7609863	0.16
350.7358398	0.20
357.8999023	0.17
361.1337891	0.09
364.0243225	0.05
372.6943665	0.07
379.0497742	10.16
380.1142883	6.16
380.7339478	0.08
383.0357361	0.15
385.2010193	0.20
388.1113892	0.22
390.8740234	0.07
392.1004028	0.11
406.5216675	0.06
436.3862305	1.27
437.1997681	0.07
445.0678101	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	301.0356
Annotation	Bracteatin
Peak:m/z	Relative Intensity
92.7856979	0.03
96.1356964	0.09
107.0190964	3.66
121.0375290	1.56
122.0328979	0.09
124.1249695	0.15
125.1198578	0.65
135.8206482	0.14
147.1624908	0.15
149.0701904	0.73
150.9565430	67.85
151.8698425	0.28
157.0959167	0.09
159.0245667	0.16
161.1510468	0.16
162.2185364	0.03
162.9461823	0.44
164.0880585	0.59
164.8935089	0.04
169.3604431	0.06
171.4761810	0.17
172.0910950	0.10
173.1716156	0.12
174.2620392	0.08
175.2390747	0.46
176.1284943	0.03
177.1010895	0.12
178.9739685	100.00
183.1229248	0.17
184.0500946	0.03
185.1012268	0.37
186.1824646	0.21
187.1406250	0.20
189.0445099	0.51
190.9828033	0.62
191.9434509	1.69
193.0762939	5.60
195.2017517	0.03
199.2328491	0.02
200.1069031	0.58
202.0707397	0.09
203.1418152	0.40
204.0314331	0.22
205.1396484	0.16
210.9879456	2.40
212.0706177	0.38
213.1284485	0.79
214.0614929	0.17
215.2181396	1.11
216.0545959	0.57
217.1311035	0.02
225.8895569	0.06
227.1677856	1.34
228.1601257	1.29
229.1262207	5.50
230.1712036	0.03
231.2949829	0.47
232.0244446	0.15
233.2861328	0.16
239.1588745	3.98
240.1713562	0.96
241.0292664	0.04
242.2354736	0.04
243.2365112	0.45
244.1167603	0.52
245.2818604	0.40
254.1951599	0.61
255.2439270	2.54
256.2327271	2.10
257.1770325	14.76
259.3923645	0.04
271.0836792	2.81
272.1324158	2.76
273.1809082	17.70
282.4432373	0.30
283.0912476	1.77
284.2248230	0.32
300.1797791	0.12
301.2795410	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	680.2073
Annotation	Unknow
Peak:m/z	Relative Intensity
221.0633240	0.48
250.7015228	0.24
262.9815674	0.03
277.3718872	0.03
280.9408569	0.07
311.3551025	0.02
323.2904053	0.64
337.9147644	0.01
341.0570374	1.01
443.1835327	0.02
485.6531372	0.02
503.2819824	100.00
504.2025146	0.22
505.1982422	0.04
506.3437500	0.05
508.8641968	0.03
518.2050171	0.15
657.4635620	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	939.26
Annotation	Unknow
Peak:m/z	Relative Intensity
525.2421265	0.44
687.3065186	6.91
705.0230713	0.33
705.7011719	1.74
770.0523071	0.31
849.6063843	3.60
858.7415161	2.00
867.2770386	9.13
913.1981812	0.34
1011.3659060	7.80
1012.4330440	0.83
1029.3510740	9.35
1109.7536620	0.26
1173.6904300	2.21
1191.4670410	8.40
1304.1768800	0.26
1335.3975830	1.42
1341.4353030	0.34
1353.8128660	1.81
1354.6441650	0.71
1457.4631350	0.34
1471.4995120	0.31
1482.8946530	0.29
1515.3818360	3.17
1516.0301510	4.01
1516.6663820	3.28
1519.6335450	0.79
1622.5474850	0.63
1634.4035640	0.58
1646.5031740	13.35
1653.1672360	0.82
1655.9549560	0.31
1661.4777830	0.50
1677.8336180	3.09
1678.6600340	1.32
1695.5438230	0.28
1700.9600830	0.43
1711.3753660	0.43
1712.2110600	2.02
1723.8883060	0.48
1739.7789310	0.26
1743.4827880	0.23
1749.9669190	0.63
1766.8786620	0.48
1767.9136960	2.55
1779.2015380	0.81
1782.6920170	2.38
1786.4473880	0.44
1788.3873290	0.41
1790.5275880	0.99
1799.1818850	0.97
1802.2673340	1.08
1803.4603270	1.31
1810.0301510	0.21
1811.6561280	1.27
1813.9512940	0.89
1818.0887450	0.31
1819.9021000	0.60
1821.9538570	1.76
1824.6383060	1.08
1826.2111820	4.94
1826.9451900	16.54
1827.8033450	0.89
1829.2261960	3.69
1831.1950680	0.97
1832.4221190	0.58
1834.2691650	1.20
1837.8846440	0.31
1839.7447510	100.00
1840.8356930	14.80
1841.6602780	0.96
1844.2972410	2.14
1847.2419430	0.39
1851.2390140	0.66
1855.0570070	0.65
1856.4818120	0.29
1859.1179200	7.61
1860.4281010	0.78
1863.2286380	1.27
1864.1521000	0.50
1866.3757320	0.47
1867.2847900	44.20
1868.2427980	0.50
1868.9630130	1.00
1871.6824950	0.35
1873.8234860	2.83
1874.9216310	16.62
1876.3122560	1.09
1876.9959720	0.26
1880.7199710	3.46
1882.7777100	7.22
1886.1929930	0.26
1887.4670410	5.62
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	289.0862
Annotation	N-gamma-Glutamyl-S-allylcysteine
Peak:m/z	Relative Intensity
109.1209717	0.22
127.9640656	100.00
153.0130615	4.36
160.0451355	2.93
161.2156982	0.07
164.1515808	0.09
171.0252991	4.10
179.0851288	0.78
185.8690033	0.07
188.9540100	0.08
197.0948181	2.20
197.9870911	0.41
199.2054443	0.33
200.3225403	0.04
202.0355835	0.07
205.1539307	0.05
209.2757568	0.23
215.0704956	9.54
219.1409302	0.07
224.8590698	0.17
240.7074585	0.08
243.0990295	0.40
245.0958862	0.36
247.1784973	0.26
253.1682129	2.70
254.3351440	0.06
255.0778198	0.08
257.0260315	0.12
258.0997925	0.17
261.1365356	0.06
262.4591064	0.04
271.2095337	40.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	384.3464
Annotation	N-stearoyl valine
Peak:m/z	Relative Intensity
118.9973450	0.18
132.1069794	0.38
152.9655457	0.16
179.0822144	0.28
192.9685364	0.17
200.1711273	0.16
218.8190918	0.43
237.1855469	0.38
251.9712830	0.23
261.2715149	0.38
268.4816284	0.20
283.9975586	0.66
290.1268921	0.34
291.6337280	0.83
294.1009827	0.19
295.3094482	1.49
296.3610840	0.85
303.3360901	0.24
304.3822632	0.43
308.3242188	27.48
309.2435913	1.19
312.2446899	0.33
318.1947937	0.16
322.2878418	1.29
326.3528748	100.00
337.3488770	0.13
339.4533386	0.90
340.5615845	0.53
347.2476807	0.95
348.4512939	3.12
366.4645081	30.20
367.3288879	0.39
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	684.1471
Annotation	Unknow
Peak:m/z	Relative Intensity
216.0438538	0.39
234.2176514	0.28
249.0836487	0.52
251.1814880	2.42
287.0158691	1.16
292.1802979	0.45
305.1118774	3.63
306.3451233	0.19
308.6091309	0.39
311.3021240	0.33
316.9143677	0.21
323.4317932	0.21
336.1602783	0.32
339.2717285	0.32
355.1520386	0.12
355.7904663	0.17
357.2714844	0.80
359.4077759	0.08
360.8881836	0.20
374.0571289	0.97
378.0932007	0.88
380.2332764	8.34
400.2125244	1.07
406.2283325	1.99
416.2860718	0.12
418.4328003	0.19
429.0316772	0.83
431.8660889	0.40
433.9855347	0.84
435.2727051	0.22
440.1054688	1.15
452.1800537	0.53
462.8579712	1.14
465.0691528	0.23
475.2332764	0.72
480.2160034	11.19
481.1223145	0.62
482.2667847	0.29
485.2267456	0.39
489.0361938	0.19
497.2178345	0.11
503.1535645	0.37
517.3722534	0.15
518.4518433	0.20
535.2794189	4.18
537.2395630	0.25
546.1145020	0.29
555.1788940	100.00
578.4480591	0.73
591.2824707	0.86
606.2469482	0.67
609.1828003	8.17
610.1090088	0.75
648.5148315	0.43
654.5289307	0.42
666.2803955	4.29
667.4771118	0.67
684.3588257	0.29
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
171.1641998	1.79
179.1697083	0.42
192.8022766	0.05
196.9840088	0.07
215.0879517	1.11
252.7144318	0.19
253.3195038	0.17
271.0458984	1.44
289.1782837	100.00
323.3795776	0.09
343.0911255	0.06
396.2695923	0.03
403.4205933	0.20
406.2807617	0.05
417.3693237	0.09
460.1651001	0.07
460.8953247	0.07
470.2705688	0.14
472.5938721	0.03
533.4948730	0.07
560.8417358	0.11
561.4442749	0.06
562.2496948	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	414.0446
Annotation	Unknow
Peak:m/z	Relative Intensity
146.8764038	0.93
156.4928436	0.27
161.9364777	0.42
175.1193237	1.65
176.1333923	0.85
219.9047089	0.44
225.4621124	0.47
278.7632446	0.96
280.3854370	0.31
283.2392273	1.20
294.0788879	36.22
297.2746277	0.30
305.9284363	2.07
322.0938721	0.51
324.0204163	100.00
325.0855103	4.36
333.0893860	1.22
334.5898438	0.20
347.2552490	0.47
352.9387207	0.53
354.1757202	1.38
364.9222107	0.47
367.2431335	1.45
370.4532776	0.31
377.8118591	1.44
380.1978149	0.36
384.2445984	1.44
385.5492554	0.71
395.5460815	6.51
396.2153625	3.90
396.8202209	0.49
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	953.1502
Annotation	Unknow
Peak:m/z	Relative Intensity
436.9282837	0.42
627.4054565	0.16
629.2631226	16.78
651.2699585	0.49
697.2593384	0.09
791.3149414	100.00
824.5819702	0.40
908.5979004	0.25
934.1403809	0.13
953.9611206	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	697.45
Annotation	Unknow
Peak:m/z	Relative Intensity
251.2073975	0.27
252.8824005	0.13
349.1257019	8.03
522.5020142	9.18
523.1080322	100.00
528.7228394	0.31
560.8646851	0.12
619.3991089	0.36
650.8384399	0.26
655.5129395	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1177.4915
Annotation	Unknow
Peak:m/z	Relative Intensity
510.3907471	0.93
731.7098389	0.20
1489.6239010	0.26
1526.9434810	0.26
1538.0050050	0.62
1600.9217530	0.26
1603.2967530	3.06
1624.0307620	0.29
1628.5601810	0.21
1646.2727050	0.26
1661.2287600	0.95
1684.5496830	0.15
1712.7906490	0.78
1729.0944820	0.42
1747.4129640	0.24
1749.5789790	0.33
1753.4909670	0.39
1778.9348140	1.03
1788.6251220	0.50
1792.5972900	0.15
1796.6822510	0.43
1814.1766360	1.34
1817.3043210	0.92
1821.1522220	0.24
1827.0513920	0.27
1833.0993650	0.35
1838.9683840	1.23
1844.9699710	6.33
1850.9553220	0.24
1854.3492430	0.50
1856.1881100	0.26
1860.7559810	2.08
1884.5228270	0.44
1885.2882080	0.19
1887.3465580	0.21
1888.1937260	0.22
1890.7059330	0.37
1894.5656740	3.07
1898.4202880	1.46
1899.2320560	0.31
1901.3342290	8.91
1903.2932130	0.62
1907.6654050	0.19
1909.7640380	2.22
1912.2557370	1.35
1913.7418210	2.95
1917.3604740	5.92
1919.7152100	8.00
1924.6234130	0.29
1925.8026120	0.34
1929.7805180	1.70
1930.4000240	0.30
1932.3785400	100.00
1933.6817630	6.57
1934.4821780	0.43
1942.7473140	0.37
1943.4793700	0.54
1944.3392330	0.34
1945.2385250	0.94
1948.3693850	4.49
1951.7237550	0.25
1953.1867680	8.03
1953.8009030	0.71
1956.1192630	12.90
1957.5867920	15.58
1959.8739010	0.31
1960.7082520	1.59
1961.5251460	0.40
1962.7999270	0.29
1964.2022710	0.71
1965.5762940	0.68
1967.6817630	1.83
1969.0789790	2.20
1970.6134030	1.08
1971.6883540	0.33
1972.8712160	0.71
1973.6003420	0.64
1974.9484860	3.25
1977.8933110	0.41
1978.8153080	0.38
1979.9494630	42.16
1981.4066160	0.17
1982.9801030	0.54
1985.3756100	0.34
1986.8751220	0.67
1988.3619380	0.19
1989.1783450	0.44
1989.8410640	0.17
1990.5339360	4.19
1991.6159670	3.40
1992.4782710	6.10
1993.7282710	3.33
1994.8634030	0.31
1995.7164310	0.27
1997.3841550	17.67
1998.5666500	3.86
1999.4190670	6.78
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	541.14
Annotation	Cassiaoccidentalin A
Peak:m/z	Relative Intensity
161.0099945	0.19
162.2984924	0.02
178.9754333	1.95
180.0890656	0.50
219.1476440	0.05
221.1400452	0.31
222.0921936	0.19
223.2143555	0.03
245.6303101	0.01
250.8419189	0.68
251.8615265	0.08
252.4676056	0.03
263.1464233	0.05
281.2073364	0.13
293.1395264	0.02
304.1278992	0.03
311.2857666	0.20
323.1915894	0.40
324.4361572	0.11
325.2204590	0.10
341.1221924	1.11
342.1744385	0.69
343.2142334	0.10
359.4694214	0.02
360.1506348	0.07
361.2564087	0.08
377.4284058	2.12
378.2593384	3.25
379.2798462	6.38
383.3851929	0.04
443.8871460	0.04
503.2864380	100.00
504.3336792	64.81
505.2922974	15.63
505.9284058	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	279.1001
Annotation	Methionyl-Glutamate
Peak:m/z	Relative Intensity
84.9257507	0.06
86.8418121	0.12
92.3088379	0.03
101.9307175	0.44
103.9845581	4.80
105.1038818	0.03
114.9573898	0.05
115.9351807	0.02
129.8654022	0.07
131.6043701	0.02
132.9240265	17.14
148.0381622	0.38
149.9698181	100.00
167.0196228	0.05
170.0899963	0.02
200.4755249	0.04
204.7464905	0.70
216.1142883	2.38
231.2952576	0.13
233.0119019	0.31
233.9681091	0.08
237.4479370	0.02
243.4811401	0.04
248.5175781	0.03
261.0922241	2.08
262.0735474	8.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	324.29
Annotation	Anandamide (18:2, n-6)
Peak:m/z	Relative Intensity
104.9574890	0.76
205.4458618	1.07
212.3208008	1.51
240.1570435	3.35
248.4022522	0.87
268.2905273	100.00
269.0616455	6.49
288.7439880	2.86
306.3489990	2.09
307.2055054	4.95
308.1629333	0.56
324.3574219	1.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	447.09
Annotation	luteolin-7-O-glucoside
Peak:m/z	Relative Intensity
133.0512543	0.77
151.1390381	1.70
173.0742645	0.26
185.018219	1.17
212.91745	0.43
241.1207581	0.61
255.4589844	0.24
257.3115234	1.23
259.0834656	0.60
269.52771	0.19
271.3830261	0.30
283.1468506	0.39
284.1107788	9.66
285.0501099	100.00
286.1083069	1.40
298.3240967	0.91
299.3053589	1.24
309.9110413	1.00
314.1027222	5.67
314.9523315	0.65
319.1273804	1.22
325.1947021	0.15
327.1747131	1.87
331.2689819	0.39
333.1399231	0.42
341.241394	4.26
343.2012634	0.36
344.3032227	0.23
346.1265259	1.11
349.0153809	0.30
351.1795044	0.52
353.4070435	0.48
356.5575562	0.21
359.2477722	0.44
360.2501831	0.21
365.7523804	0.23
381.480896	0.22
387.2572937	0.30
401.5652771	0.85
403.3579407	1.58
409.2790527	1.11
411.325592	1.15
428.5392761	0.43
429.3311157	1.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	320.12
Annotation	Tryptophyl-Aspartate
Peak:m/z	Relative Intensity
114.9534912	0.68
116.2203369	0.26
130.1417847	1.17
138.8945923	0.22
142.9257812	0.19
152.9508362	0.21
158.9971161	0.83
160.8479919	0.44
188.1199493	5.00
203.1992493	0.31
204.9649353	16.13
205.6156616	0.21
213.0679626	0.29
216.8182983	0.29
221.1264954	3.10
230.1174316	1.44
231.0385132	0.44
239.9109192	0.68
243.1043091	0.98
246.6971436	1.37
254.3682556	0.39
256.2744141	0.82
257.2709961	0.97
258.0220337	0.70
260.2661743	2.80
264.3392944	0.47
266.2208557	1.40
267.4133301	0.83
274.1520386	12.14
282.5525208	0.18
284.0853271	29.49
285.1718750	16.09
290.2719116	0.72
291.3563232	0.62
292.4135437	0.84
297.6833496	0.18
298.7604065	0.39
302.2279358	100.00
303.2034607	4.58
312.0536194	0.81
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
179.2590332	0.02
204.1555634	0.04
288.2228394	0.02
323.1830444	0.12
341.0385742	0.06
383.4568481	0.03
392.3370361	0.02
418.4328613	0.02
445.4782104	0.07
503.3089600	100.00
503.9199219	0.11
519.4501343	0.01
531.2526245	0.03
531.8884888	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	391.2828
Annotation	Di(ethylhexyl) phthalate
Peak:m/z	Relative Intensity
149.0204468	100.00
149.7851257	32.50
166.2197113	9.52
167.1001282	11.41
167.9875793	47.22
232.8780823	4.73
260.6228027	31.50
261.7124634	17.96
271.0287781	4.33
279.1076965	26.13
280.0841064	46.38
318.7593384	13.97
351.1594543	18.31
369.4871216	3.49
373.6361389	23.38
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1349.3988
Annotation	Unknow
Peak:m/z	Relative Intensity
502.6108704	0.08
647.2994385	0.01
665.0238647	0.11
707.2462158	0.03
809.7210693	0.01
827.4830322	0.09
989.3068848	0.02
1031.6232910	0.02
1049.2341310	0.02
1087.7500000	0.01
1102.4262700	0.01
1151.4571530	0.19
1187.3358150	0.01
1249.5708010	0.04
1287.3752440	0.09
1293.8067630	0.01
1313.5374760	100.00
1314.4465330	0.03
1353.8940430	0.02
1358.3796390	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	319.0968
Annotation	Antibiotic CJ 12371
Peak:m/z	Relative Intensity
102.1759033	0.03
112.9168777	0.04
124.9808426	0.09
128.0491486	7.96
138.9076538	0.06
142.1116028	1.28
145.2037201	0.03
146.0202026	1.19
148.0446014	0.90
158.8468628	0.07
172.1201477	0.16
188.8656769	0.21
190.0167236	31.52
191.0503845	0.11
193.3438263	0.15
211.8951111	0.16
217.1543274	0.06
223.0795288	0.57
227.2238770	0.06
229.2149963	0.21
236.0482483	0.04
241.0789795	100.00
242.9973755	0.07
255.4367065	0.09
257.1565857	0.05
259.2729187	0.59
261.1327820	0.06
272.1199341	0.15
273.2110596	1.21
275.1990967	3.98
276.3440552	0.05
283.1885986	0.07
298.8117676	0.25
300.4533997	0.62
301.1361694	4.64
318.2295227	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
147.2393799	0.24
152.2079163	0.12
237.3536835	0.93
238.3394318	0.12
283.5702820	0.17
313.1701355	0.20
331.3802795	0.39
337.4107666	100.00
339.1363525	0.40
341.7099609	1.08
343.1927795	0.14
355.1691589	0.30
375.5671082	0.28
387.9745483	0.17
406.1496277	0.36
419.9558716	0.17
431.4234924	0.31
447.3338318	1.25
448.3220520	0.29
460.3383484	6.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	289.09
Annotation	N-gamma-Glutamyl-S-allylcysteine
Peak:m/z	Relative Intensity
86.0171204	0.30
88.0004959	0.06
126.2265320	0.05
128.0611572	100.00
152.9658203	2.59
160.0224762	1.71
167.0744171	0.07
171.0415955	15.24
178.9938354	0.79
196.9973755	1.15
215.1076355	15.98
231.1643066	0.02
253.0693970	2.18
271.0884399	24.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	291.2
Annotation	Unknow
Peak:m/z	Relative Intensity
145.0672913	0.77
145.9254456	0.03
147.1278076	0.03
201.1113586	0.20
231.0349731	0.07
245.1486511	100.00
247.0313416	86.62
259.0974731	0.04
260.5130310	0.03
263.0097046	1.30
264.1044312	0.04
273.1857910	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	279.1001
Annotation	Methionyl-Glutamate
Peak:m/z	Relative Intensity
84.9486923	0.17
87.0418320	0.23
96.7916260	0.03
102.0075531	0.22
103.9226761	4.60
104.8976593	0.13
130.0285187	0.27
133.0145111	16.16
148.0607910	0.24
150.0168610	100.00
166.3773193	0.08
167.2645264	0.03
197.1509399	0.03
204.8931885	0.89
214.9816895	0.23
216.1898499	1.83
225.1415405	0.10
231.1196594	0.22
232.8859863	0.24
236.2338257	0.18
243.1797180	0.18
250.7511292	0.04
261.0581360	1.47
262.1653442	7.83
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	386.9395
Annotation	Unknow
Peak:m/z	Relative Intensity
158.9959717	0.62
227.8465881	0.02
228.9917908	0.18
240.8879395	0.06
245.2533569	0.02
247.0875854	0.01
257.1969910	0.03
271.1822815	0.17
272.9860840	100.00
273.7548523	0.01
297.2488098	0.06
302.3062744	0.01
312.3088989	0.01
341.0870667	0.06
342.7902222	0.06
357.1570740	0.03
357.9992371	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	503.08
Annotation	Unknow
Peak:m/z	Relative Intensity
146.8877563	0.12
160.5924835	0.09
162.9232941	0.84
175.1587219	0.28
187.0535583	0.33
214.7988739	0.17
217.2412720	0.56
219.1078796	0.41
221.4846954	0.34
248.1755676	0.13
274.1721497	0.12
284.3265076	0.75
285.4075623	0.41
290.9295654	0.19
307.0786743	0.15
309.7035522	0.10
311.0709229	0.35
323.1678162	2.20
325.3926086	1.45
341.2566223	0.28
343.3255005	0.08
373.1600952	3.20
373.8143005	0.23
386.0470276	0.14
395.1068420	0.52
399.2163696	0.66
400.2601929	0.23
413.1578979	100.00
414.1474304	53.48
427.1882935	0.53
428.4057312	0.19
431.4520569	0.16
437.3704529	0.32
438.8686523	0.57
460.2292786	0.22
467.3872986	0.64
484.5102844	0.98
485.3298645	1.99
488.0972595	0.53
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	636.2679
Annotation	GW 6471
Peak:m/z	Relative Intensity
193.1097412	0.52
207.0052948	0.61
211.0736389	0.35
223.0369873	1.99
224.9976501	0.53
229.0991974	0.47
241.2154846	0.49
243.1884460	0.15
247.1403351	1.29
250.9613342	0.42
253.0524902	5.13
256.5050354	0.19
258.4114990	0.86
259.0802002	5.20
260.7275391	0.35
270.9781494	7.21
275.8508606	0.76
276.8152771	2.33
289.0130005	29.35
293.8906250	6.08
306.5569458	2.81
307.2506104	0.87
311.9372559	1.52
324.9385986	100.00
325.5855713	0.21
339.1975708	0.67
342.3103027	6.35
342.9868774	27.65
390.0885010	0.25
420.3169556	0.35
455.5793457	0.26
456.2398682	7.38
474.1159668	29.37
474.7636108	0.43
486.8437500	7.30
504.6409302	5.84
521.9494019	0.99
618.0227661	0.19
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
114.9690704	5.61
115.9215088	1.53
130.9662476	0.19
131.9495850	0.11
145.3101807	0.02
156.9988403	0.02
158.9751587	100.00
160.0001373	29.67
160.7158813	0.01
174.1097565	0.03
183.3087463	0.01
199.0402832	1.71
200.0215454	1.22
200.8470459	0.06
216.9793701	0.80
218.0793457	0.71
228.9894409	20.41
229.9566650	14.45
243.0989990	0.01
244.2845764	0.05
245.1394958	0.28
246.0219727	0.47
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	491.1619
Annotation	Unknow
Peak:m/z	Relative Intensity
148.9880829	100.00
150.1164703	1.69
209.9135132	0.43
213.8133240	0.19
269.8425293	0.08
272.1395569	0.21
297.0289307	0.13
306.0214539	0.77
311.7699280	0.16
315.2535400	0.15
322.0358887	0.27
326.0263367	0.18
329.9106140	0.70
331.1217346	0.15
341.0247803	1.37
342.3056335	0.61
354.0624695	0.85
360.1990356	0.17
371.1102295	0.47
372.1207275	0.21
380.1187744	0.20
474.3755798	0.73
475.2365417	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	397.091
Annotation	4'-O-Demethyldehydropodophyllotoxin
Peak:m/z	Relative Intensity
118.9004364	0.41
122.1446304	0.27
123.0415421	0.21
138.6276245	0.27
145.3406372	0.23
146.7446442	1.08
147.9550476	0.67
151.8985596	7.85
157.0280762	0.38
161.9876709	4.51
163.0873413	0.60
166.6258545	0.11
170.1394348	1.64
176.1095581	0.60
179.0131531	6.07
181.0180359	0.15
189.3135071	0.46
192.1070862	0.35
193.9019623	45.31
196.8876495	0.73
198.0868530	0.39
202.0987854	1.72
207.2444611	0.11
208.9904175	0.11
210.0881805	0.95
210.7605591	1.32
215.7381897	0.14
217.1493530	2.36
220.1033783	0.49
222.1055908	0.25
223.3817444	0.23
225.0678101	0.27
227.9588013	7.94
232.0479126	0.12
234.8292847	0.12
237.2183228	0.14
239.1848450	0.21
242.0991821	0.32
249.1803894	13.78
253.2683411	0.23
255.3183899	0.15
256.3035278	0.62
261.3874207	0.11
267.9497070	100.00
268.6082153	0.42
271.0984497	0.27
277.2918701	0.22
279.2505493	0.10
281.2452698	0.16
286.9341125	0.22
293.2320557	0.49
294.4130249	0.31
297.2221680	0.14
306.1271667	0.11
307.0703430	0.54
307.8622742	0.29
317.3822327	0.11
318.1318665	0.23
319.6073303	0.68
321.3333740	0.24
323.0402527	22.10
325.6817627	0.34
334.1616821	0.38
336.3358765	0.47
340.1241760	0.80
351.0430908	0.50
355.2931824	0.85
356.5592346	0.10
361.5968628	0.27
367.8993835	0.40
369.2274780	0.35
374.1934814	0.14
378.5993042	2.57
379.2466736	2.32
380.1404114	4.94
386.2469788	1.19
388.7695007	0.20
397.3642578	0.43
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	377.09
Annotation	D-Galactofuranose
Peak:m/z	Relative Intensity
112.7999496	0.16
125.1191864	0.05
130.9773102	0.02
143.1423340	0.07
148.9450836	0.05
160.9979706	0.13
179.0622864	1.68
197.0795135	0.49
215.1374512	8.14
220.9965210	0.07
250.7924500	0.23
341.1987915	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	641.1685
Annotation	Nervilifordin C
Peak:m/z	Relative Intensity
228.9305420	0.08
239.4043274	0.08
242.9574280	0.02
257.4671021	0.36
261.0455933	0.02
271.1019287	0.09
273.1029663	0.17
274.2019348	0.05
285.0411987	0.30
289.1560059	0.03
302.1416016	1.54
314.8262939	0.03
317.1621094	100.00
317.7627869	0.39
324.9229736	0.25
326.0654297	0.02
329.1148682	0.08
341.3309937	0.39
357.4337769	0.06
359.2648315	2.77
368.3374634	0.11
383.1845093	0.62
395.3506470	0.07
413.1989136	0.27
425.3874512	0.19
438.3970337	0.04
443.2061157	0.76
461.2980347	4.65
479.1202393	25.94
479.8438721	0.05
503.1806030	0.03
511.3721313	0.13
521.1449585	0.13
575.4974976	0.17
595.1759644	0.19
596.4155884	0.10
605.1928711	0.08
613.3562012	0.05
623.3787231	0.57
639.4660034	0.16
641.1648560	0.90
642.2724609	0.18
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
161.0369110	0.08
179.0504456	0.35
196.9405518	0.11
203.2200470	0.04
214.9462891	0.17
218.9739685	0.04
221.1143494	0.03
233.1396484	0.31
275.0026855	0.08
305.2801514	0.02
323.2358398	2.32
341.3128052	0.45
359.1813354	0.93
377.2102661	0.32
383.3411255	0.38
412.8575439	0.04
443.4244385	0.12
503.2960205	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1171.6229
Annotation	Unknow
Peak:m/z	Relative Intensity
364.3444214	0.80
903.5604248	0.67
1478.9951170	0.26
1524.2518310	0.23
1561.3817140	0.11
1572.3229980	0.14
1655.8946530	0.19
1672.1125490	0.80
1689.2668460	0.24
1726.7215580	0.26
1728.6452640	0.18
1743.8900150	0.78
1747.4196780	0.35
1761.4674070	0.28
1763.8986820	0.23
1767.2473140	0.40
1771.1698000	0.19
1782.9427490	0.16
1784.3807370	0.33
1793.8424070	0.18
1798.7088620	3.74
1807.0526120	0.77
1807.9781490	0.76
1817.1610110	0.33
1824.5030520	1.38
1830.2863770	3.66
1830.9366460	0.24
1834.4534910	0.73
1841.2684330	0.46
1849.8475340	0.52
1850.7819820	0.41
1855.4202880	0.79
1857.2105710	0.31
1867.2989500	0.19
1878.4377440	0.92
1881.3146970	0.41
1883.3448490	0.91
1884.2286380	0.67
1885.2872310	0.28
1887.7873540	0.50
1889.6496580	1.41
1890.2526860	1.16
1891.9356690	0.14
1893.9046630	0.25
1898.1237790	0.48
1902.1232910	0.19
1904.6531980	0.21
1905.8931880	0.61
1906.9973140	30.27
1907.9367680	0.74
1909.3010250	7.94
1913.7175290	14.09
1915.4447020	26.34
1916.9187010	0.30
1918.4128420	9.31
1920.3421630	1.42
1923.4681400	5.55
1926.3669430	1.40
1927.3497310	2.35
1929.3260500	0.15
1932.5628660	0.71
1933.4161380	100.00
1934.3797610	1.03
1938.2344970	0.52
1938.8470460	0.31
1939.8914790	0.43
1942.8519290	0.38
1944.3973390	5.51
1945.2346190	1.06
1946.8541260	2.04
1949.0733640	1.73
1950.6905520	7.65
1953.0423580	1.47
1956.3122560	11.50
1957.7879640	0.33
1959.1607670	0.70
1960.9509280	0.24
1964.5905760	0.26
1965.4343260	0.23
1967.4847410	11.62
1968.4027100	8.25
1969.3243410	8.14
1970.2204590	4.07
1972.0528560	3.19
1973.6579590	1.16
1975.4681400	0.57
1976.0716550	1.09
1976.9144290	0.33
1977.7635500	0.35
1979.3865970	0.41
1980.3137210	0.46
1981.3223880	8.67
1982.8153080	8.65
1983.8679200	14.29
1984.7808840	0.33
1985.6031490	1.14
1987.6892090	0.96
1988.7174070	4.16
1991.6555180	1.80
1992.9342040	38.23
1995.1571040	3.99
1995.8853760	2.35
1997.8128660	84.16
1999.5399170	0.35
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
86.0417175	0.25
87.0209351	0.16
87.9057083	0.33
94.3150787	0.08
95.9298782	0.07
97.0681152	0.09
99.9592514	1.75
102.0154572	0.12
105.9222107	3.57
112.0901337	0.15
112.7761688	0.07
113.8878708	0.44
116.0530167	2.79
119.0364532	0.05
121.0612183	0.29
125.0919647	0.50
125.9891663	0.83
126.9875946	0.74
128.0559387	15.48
128.9962463	0.31
131.1365967	0.56
132.0513763	0.12
135.2568359	0.18
137.1204224	0.25
139.1678619	0.08
141.0523987	1.92
141.9507751	0.96
143.0939941	2.26
143.9888611	0.86
146.2136536	0.44
149.1194153	0.19
151.1000061	3.49
153.0920105	2.84
153.9803772	0.33
155.2231445	0.07
156.9950104	0.17
160.0558929	36.26
164.3177643	0.33
165.2089844	0.77
167.1020203	0.55
169.0186157	13.52
169.6823730	0.25
170.2891541	0.19
171.1317139	0.40
173.3067017	0.16
175.0191803	20.69
175.9862976	2.22
176.9013062	0.47
178.9828949	7.61
179.9818726	0.10
181.1339264	0.47
182.1796875	5.74
183.0003662	0.36
185.0805054	9.79
186.0715790	0.58
187.0281982	0.21
189.2634277	0.09
195.1459656	0.33
197.0740356	37.22
198.5186157	0.35
199.1737671	0.47
200.3514099	0.22
201.1604004	0.86
203.1166992	11.95
205.2070618	0.10
208.1005249	5.54
209.0572510	0.09
211.0473938	3.95
214.0746765	0.24
215.5024414	1.05
216.2719421	0.20
217.0709534	0.37
217.7789612	0.13
219.4559937	0.38
223.3822327	0.08
224.2467651	0.40
226.1639404	24.22
229.1759033	4.56
231.1253357	0.22
232.1010742	0.07
240.1351929	0.76
242.0137329	2.50
243.2285767	0.27
246.1203308	0.13
252.1583862	23.38
254.2189331	0.15
255.2246399	1.91
258.0500793	0.24
259.1348877	0.16
260.1847839	3.91
260.9021912	0.13
267.0497742	0.71
268.2687988	0.08
270.2518616	4.72
274.2938843	0.12
275.3582764	0.16
283.1346436	0.23
286.1184692	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	564.1925
Annotation	Unknow
Peak:m/z	Relative Intensity
197.3278503	0.14
235.2219086	0.07
257.1223145	0.19
277.3799438	0.11
307.3863525	0.05
338.9638062	0.11
353.2164307	13.42
387.2687378	0.19
399.1008911	21.24
417.2200317	0.12
430.2711182	0.42
434.5221558	0.25
444.2673340	0.30
464.2960815	0.11
466.8568115	0.21
473.2937012	0.14
474.2910156	0.08
516.2192993	0.13
518.1770630	100.00
518.9586792	0.50
520.3983154	0.06
527.5311890	0.06
536.1779785	0.08
543.3068848	0.21
545.9273071	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	476.06
Annotation	Unknow
Peak:m/z	Relative Intensity
152.0462189	0.12
161.9380798	0.43
200.2562866	0.32
213.4016724	0.28
221.3801575	0.24
252.2245789	0.26
263.3989868	0.65
278.5939331	0.15
313.2203369	0.60
323.4449158	0.14
325.5880127	0.26
327.2706299	0.13
331.3124695	0.44
343.1482544	0.15
346.9893799	0.58
363.3789978	0.46
384.1916504	0.17
386.0968323	0.16
413.0832825	100.00
413.7958069	1.08
416.1267395	0.57
423.4044800	0.40
429.0843811	0.24
430.0856628	0.83
439.2718201	1.22
440.3864746	1.50
447.1997681	0.17
449.4353027	1.40
451.4204407	0.16
457.6292114	1.68
459.4104004	0.20
467.4856873	0.72
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	710.65
Annotation	Unknow
Peak:m/z	Relative Intensity
206.9446411	0.32
215.6997833	0.34
290.8671570	3.18
374.6247559	1.30
458.5988770	21.17
534.6782837	1.04
536.0220947	4.15
537.1582642	0.85
542.1168823	28.83
542.7958374	100.00
625.7621460	40.62
626.5806274	31.97
627.2545776	0.18
651.0568848	0.32
664.0215454	0.52
664.7188721	0.74
687.4367065	1.00
692.2085571	2.64
693.0797729	2.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	729.23
Annotation	Citbismine C
Peak:m/z	Relative Intensity
221.2368774	0.07
223.0901947	0.04
224.1795959	0.81
225.0601044	0.18
323.1084595	0.20
341.0551758	0.46
383.2263794	0.17
385.4335938	0.17
443.2098389	0.09
447.0897827	0.15
459.0441895	0.06
462.3244019	0.10
485.3635254	0.60
503.2025146	0.27
539.3900757	0.17
545.5073853	0.13
546.5457764	0.11
547.4575195	0.40
548.2782593	0.21
566.2356567	0.52
611.4845581	0.04
665.3727417	100.00
666.4183350	22.22
691.2484741	0.06
692.8945923	0.14
708.3572388	0.37
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1279.3235
Annotation	Unknow
Peak:m/z	Relative Intensity
387.5490112	0.12
476.1625061	0.69
477.2722778	1.30
519.0786743	0.13
611.5268555	0.24
633.0631104	0.12
639.3228760	100.00
1116.7607420	0.10
1199.7756350	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	516.0968
Annotation	4beta-(2-Aminoethylthio)epicatechin 3-gallate
Peak:m/z	Relative Intensity
153.3280792	0.07
156.9050293	0.06
165.9757385	0.08
166.9846497	0.06
169.1275635	0.57
175.2604675	0.09
177.3396912	0.03
179.1375580	0.48
181.0457764	0.32
185.4262543	0.15
192.2993011	0.08
196.7947083	0.14
202.0050964	0.05
203.0012665	1.78
210.1559448	0.92
211.0746765	0.06
215.1083069	0.88
224.2065735	0.07
228.1649933	0.05
231.1145630	0.61
249.1874542	3.19
252.2264404	0.18
254.1951904	5.67
259.2324524	0.15
267.3444214	0.11
269.9078064	0.09
272.1123352	25.75
282.2188110	0.09
286.1629028	0.52
288.1030884	5.63
291.3244629	0.06
297.1931763	0.12
303.0891724	0.06
304.1469727	1.28
305.1333008	0.08
306.1528320	17.57
314.0882568	0.04
321.3704224	0.06
322.2570801	0.03
326.0844727	0.60
334.0827637	0.04
335.6061401	0.03
337.5646362	0.09
344.0082397	0.15
360.1958008	8.69
372.5015259	0.04
378.1431885	100.00
378.7529297	0.11
385.2088623	0.11
410.1558228	0.11
416.4496460	0.14
418.0641479	0.18
423.6737671	0.09
435.4617920	0.17
438.4901733	0.19
442.2749634	0.06
450.2268677	0.94
452.2780151	0.03
459.3385010	0.13
460.2720337	0.20
462.2872925	0.12
471.3727417	0.07
472.0703735	0.13
478.3225708	0.31
479.5563965	0.17
480.1801147	0.04
481.7396240	0.08
484.1465454	0.12
485.3452148	0.06
497.5314331	0.36
498.3341064	0.79
509.9227905	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	502.92
Annotation	Unknow
Peak:m/z	Relative Intensity
158.9027100	3.63
159.9426270	1.56
161.1035767	1.23
198.9542542	0.07
199.7532959	0.16
201.0614319	0.33
216.9283142	0.19
218.9957886	0.13
229.0630798	1.63
230.9019165	0.54
273.0168762	48.13
274.0318909	30.36
275.0005798	27.58
291.2188721	0.10
387.0164490	54.92
387.9986267	100.00
389.0206299	86.54
429.3769836	0.26
434.6734009	0.10
456.0198364	0.09
457.9477234	0.50
459.2265625	0.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	377.09
Annotation	D-Galactofuranose
Peak:m/z	Relative Intensity
113.0435944	0.07
119.2537384	0.03
130.9604797	0.03
143.0481567	0.23
149.2852936	0.02
161.0367432	0.46
179.0870361	2.41
197.0415955	0.55
215.1091766	8.01
250.8438110	0.13
263.0502319	0.02
323.2324219	0.14
341.1630249	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	490.0778
Annotation	Unknow
Peak:m/z	Relative Intensity
254.2031860	0.16
263.0871582	0.08
272.1135559	0.34
297.5667725	0.11
299.9353027	0.03
306.1943665	0.10
307.4179993	0.05
374.2910156	0.51
392.1928101	100.00
392.8397827	0.14
400.1845398	0.08
415.0669861	0.04
416.1880798	0.03
446.3168335	0.04
472.1032104	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	581.1925
Annotation	N-gamma-Glutamyl-S-allylcysteine
Peak:m/z	Relative Intensity
170.0989990	0.52
172.2631073	0.10
181.9583893	0.18
188.1373444	0.09
216.0949097	0.15
227.3318481	0.11
228.1306763	0.35
234.2594604	0.19
245.0978699	0.17
273.0366821	0.43
274.1316223	1.08
291.0805054	100.00
491.2600708	0.16
543.1177368	0.04
563.0382690	0.67
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	311.221
Annotation	trans-EKODE-(E)-Ib
Peak:m/z	Relative Intensity
92.95172882	0.50
107.0025864	0.27
109.1191559	1.03
111.1394501	0.87
124.9074707	2.47
129.2392426	0.61
138.3536377	1.59
139.3114014	1.43
141.1045227	0.24
142.9807739	0.98
143.7109375	1.00
149.1832581	0.68
150.9376831	0.42
152.8764343	0.69
155.0544128	0.75
157.1567383	0.77
163.2746429	0.71
169.1917725	2.33
171.1031494	0.55
177.1881104	2.11
181.1006775	7.04
182.9022522	3.27
191.4654236	0.89
195.1398926	2.40
199.093338	0.27
200.9965515	1.50
205.3107605	0.37
211.1842041	1.30
213.0704956	1.35
217.1040955	0.21
223.0938416	0.51
225.1920471	1.10
227.1361084	2.58
229.1619873	0.74
233.1548157	0.45
235.8025513	0.63
237.2266541	1.02
239.3370361	3.55
241.191925	1.52
247.0410156	0.84
251.0792847	2.08
253.1036377	4.64
265.3650513	1.08
267.2389221	4.06
269.1223755	1.80
270.141449	1.07
275.1096802	7.03
275.753418	1.26
283.2675171	5.17
288.0862427	0.49
288.7921753	2.39
293.2093811	100.00
298.6459045	1.71
302.309906	0.72
311.1477661	0.85
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	381.1013
Annotation	Unknow
Peak:m/z	Relative Intensity
115.9007263	1.90
129.9122925	9.65
143.9346619	0.94
145.2548218	0.22
149.8663940	0.49
162.0390015	16.05
162.9732056	2.27
169.8436279	2.25
171.0155029	0.92
178.9299927	22.26
180.1215820	0.99
180.9978638	1.43
202.0055542	11.98
203.0068970	0.36
204.1780396	0.24
205.0230255	0.52
211.1163483	3.20
214.3906860	0.61
219.1420898	52.91
220.1101074	2.09
220.7679901	0.31
221.7306976	0.56
225.2545471	0.27
227.2309570	0.39
244.8204346	1.57
251.0381775	4.29
252.1608582	2.16
253.0574951	0.32
253.9415894	0.49
261.1057434	0.41
265.0590210	7.96
265.6599731	6.67
266.2990112	1.30
272.2621460	1.17
273.2893066	4.15
274.1798706	1.43
279.3611755	1.10
280.1633911	0.29
285.1083679	7.86
286.1860046	0.48
287.3304138	0.67
290.0074463	0.53
291.0740967	3.00
305.2004700	2.18
308.2188721	22.66
309.3161926	0.71
310.3052368	1.30
316.7108459	100.00
317.8925171	4.24
318.8905945	1.90
319.8099365	0.29
321.6016846	0.37
322.9939270	0.31
325.0571289	4.78
331.2258911	0.90
332.1773376	1.12
335.0090942	3.05
336.2081909	0.42
343.7332458	24.57
344.8460083	1.20
348.1516113	12.34
349.0989990	2.24
352.7214050	2.39
353.5736694	0.34
363.3540344	3.66
372.6113281	11.22
414.1496887	80.93
415.2727661	16.77
416.1593323	3.18
425.2669983	0.44
454.1990051	39.18
455.2815552	7.61
456.2695007	0.64
503.2485657	15.14
504.3565979	4.54
505.1811218	0.39
512.1554565	12.92
513.2279053	6.87
556.9572144	0.71
558.1438599	0.27
559.1889038	1.04
614.3438110	1.08
615.1749268	1.12
616.3916016	0.52
632.3276978	10.53
633.2962036	5.50
634.3678589	3.29
686.5447998	0.99
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	630.88
Annotation	Unknow
Peak:m/z	Relative Intensity
217.1013947	0.12
228.8962555	0.12
233.1498871	0.03
245.1377563	0.24
247.8320312	0.01
273.1388855	1.74
275.3061829	0.03
289.0700073	3.01
377.0039673	0.04
387.0897827	1.96
390.0106812	0.06
403.1080933	18.25
501.0372925	0.51
503.0890503	0.04
515.1912842	0.60
516.9858398	100.00
527.9728394	0.08
528.8992920	0.07
538.3088989	0.11
539.2880249	0.03
540.2148438	0.15
540.9845581	0.01
557.0248413	0.13
558.0057983	0.02
584.0248413	0.40
585.0851440	0.42
586.8220825	0.03
588.2338257	0.06
597.7672119	0.08
601.3844604	0.03
620.0328979	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	623.0344
Annotation	Unknow
Peak:m/z	Relative Intensity
245.0587769	0.12
262.3696289	0.10
306.0451660	0.41
309.3828125	0.20
315.2299194	0.42
320.9028931	0.07
322.1914673	0.10
339.1304321	0.10
346.2299805	0.09
379.9812012	0.07
399.2257690	0.23
401.9183960	0.09
413.2367554	0.07
415.0957642	0.38
428.2281494	0.20
429.2259521	0.14
442.0712891	0.16
459.2716675	0.17
460.6727905	0.20
471.2896729	0.25
471.9022827	0.05
475.4205322	0.08
477.3037720	1.12
478.3355103	0.18
489.3671875	0.11
492.0737915	0.23
514.2325439	0.09
518.2572632	0.23
527.6946411	0.07
530.0018921	0.70
531.1718750	2.99
532.1721191	0.58
533.2219849	0.63
534.5444336	0.10
549.2753906	0.25
558.9884644	0.10
563.2460327	0.07
576.1304321	15.38
577.1592407	100.00
578.4440308	1.03
579.1842041	1.32
586.9660645	0.11
603.5161133	0.09
604.6084595	0.35
605.3181763	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	277.1061
Annotation	Asn Gly Ser
Peak:m/z	Relative Intensity
106.9821701	1.04
134.2627258	0.22
150.9603271	0.15
157.1433105	0.65
161.1362457	0.32
167.1763	0.13
170.9687805	8.08
173.0689697	0.79
177.4381561	0.32
178.9549561	0.39
192.9611816	0.23
195.1548462	0.14
202.1612854	0.46
203.4168701	0.14
211.5543823	0.17
221.3296814	1.44
225.124054	1.00
227.0776978	0.20
231.0734863	0.79
235.1705933	6.55
241.1272583	0.69
259.1121521	100.00
260.1588135	0.35
271.0131226	0.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	359.1786
Annotation	Unknow
Peak:m/z	Relative Intensity
125.2858276	0.06
131.1546631	0.08
139.9320221	0.51
145.1028595	16.24
145.8322144	0.12
150.1444092	0.02
166.1034241	0.08
167.0103760	0.30
173.2483063	0.02
182.2452087	0.02
185.1169128	0.16
193.9197388	0.03
195.9452209	0.47
206.1262512	0.03
210.9802551	0.07
213.1775818	1.42
213.9721985	0.02
215.6538086	0.05
221.0973816	0.06
222.1271973	0.08
223.1629639	1.00
227.2695007	0.09
228.8034668	0.05
231.1072083	1.15
240.1885376	6.99
241.0834656	0.24
243.3547668	0.04
257.6016846	0.39
258.2148438	1.33
262.1032715	0.05
263.3170166	0.22
267.0780029	0.28
269.1962585	0.04
275.3140869	0.19
277.0095520	0.05
279.3078918	1.76
280.2387390	0.96
285.2526245	0.17
294.2523499	2.46
295.6174622	0.38
296.2264709	9.98
297.3055115	0.56
298.4205627	0.27
300.6571350	0.05
302.2000122	0.09
311.9425659	0.87
313.2702942	100.00
314.2709961	3.24
315.5226440	0.04
317.3594360	0.03
323.2551270	0.05
323.9158630	0.03
325.4594727	0.11
331.1786499	35.60
331.9911804	0.06
333.1116943	0.16
339.2871094	0.06
340.5607910	0.19
341.4240417	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	393.12
Annotation	Unknow
Peak:m/z	Relative Intensity
119.0747681	0.02
126.1616898	0.04
127.4423981	0.19
128.0930328	2.53
129.1410522	0.17
135.1043396	0.06
136.0956573	0.02
139.1784363	0.02
140.9961853	0.02
143.0526733	5.86
144.0355530	0.60
145.2615051	0.17
146.1025543	0.57
152.8772430	0.10
155.1662292	0.02
160.0197449	0.18
166.3131104	0.13
167.1532898	0.35
168.1058350	0.15
170.1197205	0.17
171.0585938	0.35
172.2895050	0.05
177.1768188	0.32
178.0988159	0.03
179.1279297	7.36
180.1292725	0.91
181.3667297	0.03
185.1773071	0.34
186.1009216	0.16
188.1424561	0.03
192.3024750	0.16
193.0620880	0.07
196.1657715	0.08
197.2187195	0.70
198.2514038	0.09
210.1679840	3.99
211.2044525	0.47
213.2557678	0.14
214.0968323	0.03
226.2290955	0.04
228.0776978	0.31
228.9761353	0.05
236.3763428	0.36
237.2344360	0.07
242.3615112	0.14
245.2705078	0.04
248.1199036	0.01
254.1565552	75.18
255.1662292	8.51
263.1677856	7.13
264.2059021	0.43
272.1676025	100.00
273.1521301	10.77
288.1419678	4.57
289.2243347	0.71
298.7465210	0.03
306.1723633	46.96
307.2283325	5.83
374.1629944	22.23
375.2503967	3.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	711.2197
Annotation	Unknow
Peak:m/z	Relative Intensity
207.2199402	0.19
208.3831329	0.05
368.2912598	0.04
433.0996704	0.10
445.4680786	0.34
548.5376587	0.10
550.2016602	0.13
556.3484497	0.18
597.4239502	0.19
601.2656860	0.10
613.3972778	0.07
619.4011841	0.31
626.7605591	0.04
647.3084717	0.21
665.4639282	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	567.1
Annotation	Unknow
Peak:m/z	Relative Intensity
182.1357117	0.13
194.2696533	0.11
211.1079712	2.02
212.0966949	0.46
213.1664276	0.32
241.1697540	1.26
242.2135010	0.32
243.4292450	0.08
262.2557983	0.06
273.2612305	0.05
274.1927795	0.20
280.1552734	0.84
281.1586304	0.58
282.1936646	0.19
306.1719360	0.22
321.1494751	0.80
323.1558838	72.26
324.1371460	100.00
325.1484985	17.18
352.1862793	0.11
361.2852173	0.12
374.9930420	0.10
376.3223267	0.27
385.1675415	0.93
386.2686768	2.17
387.1733398	2.35
390.8711548	0.29
393.0744629	2.30
395.7868652	0.06
403.2183228	2.15
404.2203979	1.72
405.1403198	0.20
413.1428833	0.40
428.8383179	0.19
430.8943481	0.93
440.8739624	0.13
445.3828125	0.23
468.1994629	0.43
469.0347290	0.18
469.7363281	0.10
480.8295898	0.08
482.9296265	7.46
548.1235352	0.30
550.4335938	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	348.12
Annotation	1,2-Dimethoxy-13-methyl-[1,3]benzodioxolo[5,6-c]phenanthridine
Peak:m/z	Relative Intensity
102.8791580	0.89
116.0708923	0.88
122.0347137	0.45
143.9845428	3.49
162.0154419	10.45
170.0522156	13.17
179.0781403	40.88
201.9502106	15.56
219.0993958	100.00
224.1656189	2.41
225.8610840	1.25
245.0975342	3.03
254.7032471	1.48
257.9185791	3.70
261.5442505	2.68
263.6176147	0.78
271.0278320	0.71
273.1930847	18.39
290.1643677	1.12
299.0791626	0.96
302.3498535	0.37
313.4347534	0.90
329.2556458	0.57
330.2615051	15.22
331.3876953	2.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.11
Annotation	Lactulose
Peak:m/z	Relative Intensity
128.9710083	0.24
172.9229126	0.18
175.1386108	0.06
217.1010132	0.09
239.7009583	0.25
250.9201355	0.99
265.1493225	0.09
302.9676514	4.57
313.1287231	0.14
328.9623718	0.11
341.2195129	100.00
369.8265686	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	453.15
Annotation	(9R,10S)-rel-(-)-9,10-bis(Acetyloxy)-9,10-dihydro-5-methoxy-8,8-dimethyl-2-phenyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one
Peak:m/z	Relative Intensity
145.9829407	0.67
162.1528931	0.41
173.1828613	0.19
187.9800110	2.56
205.1272888	6.25
208.2859344	0.36
223.1117554	0.23
238.0323334	0.51
249.2871399	0.79
256.1101074	0.81
258.0786743	0.17
274.0313416	6.67
280.5612793	0.08
288.2566833	0.64
291.1778259	0.91
319.5556030	0.51
324.2411804	0.36
361.2964172	0.42
369.1757507	15.31
376.9689026	0.14
381.2719727	0.56
399.1807556	2.33
407.0851135	0.58
408.5976257	0.31
417.2512817	34.13
435.1693115	100.00
435.8507996	0.47
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	607.3725
Annotation	Lanceolitol B6
Peak:m/z	Relative Intensity
201.0353088	0.02
210.8274689	0.02
244.8346252	0.02
259.2098389	0.74
261.0776672	0.29
261.7221375	0.03
272.4706116	0.03
275.2007446	0.04
291.2038574	0.07
292.2814941	0.03
296.6614380	0.07
297.3713379	0.05
315.2574463	43.24
317.2968140	0.06
333.0676880	0.05
345.2407837	0.16
347.0189209	0.02
359.2255859	0.36
360.4718018	0.49
361.4268188	1.95
375.3182983	0.22
376.4605713	0.31
377.5694580	0.12
389.5278320	0.13
391.3815308	0.33
392.4475708	0.12
393.0646362	0.03
399.3294067	0.03
415.1422729	0.07
425.0676270	0.09
432.2802734	0.02
461.2364502	100.00
461.9393311	0.32
479.3654175	0.23
516.4190063	0.09
517.3299561	0.18
533.6331177	0.04
534.3801880	0.02
543.4262695	0.07
560.6485596	0.04
561.3241577	0.21
571.3197021	0.03
589.3801880	0.03
591.2232056	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	520.11
Annotation	Ceforanide
Peak:m/z	Relative Intensity
156.0966339	0.37
169.9231567	0.21
179.0260010	0.66
221.0623779	0.66
227.8437805	0.49
253.1875000	0.45
259.3924561	0.67
261.0861816	2.22
269.1462402	1.15
283.9520264	0.33
285.2758179	1.21
304.2451782	0.94
308.0764771	0.43
317.1605835	0.66
319.2221680	0.92
324.2446289	0.25
330.4125977	0.23
348.3006592	1.23
349.0762939	0.78
356.9248657	1.28
358.3905640	1.20
359.0172119	10.00
369.2659302	0.29
387.0354614	0.58
390.1942749	0.96
391.1782837	6.81
412.1073608	1.49
413.3435669	0.86
415.0133667	0.37
419.1004028	0.65
420.3688965	0.51
430.2814941	0.25
436.0733643	0.89
439.7957764	0.54
445.1527710	1.17
445.9350586	0.23
447.2244263	1.97
448.1325684	20.51
456.4233398	0.43
463.4176636	1.69
475.3405151	0.25
486.1522217	1.05
487.3058472	28.69
488.1769409	100.00
488.9221191	0.18
502.1870728	2.85
521.6328125	0.43
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	633.0992
Annotation	Unknow
Peak:m/z	Relative Intensity
182.6902161	0.11
183.9032135	0.19
185.2061920	0.06
210.1939850	0.07
211.9814301	0.11
215.0092468	1.84
216.0413055	2.55
225.2405548	0.33
231.2331848	0.10
241.8351440	0.13
254.1017303	0.15
255.2366791	1.41
256.1254883	14.29
256.9955444	0.19
258.0339966	0.29
266.0507812	0.43
269.1460266	0.81
283.0895996	0.10
289.2338257	0.30
290.3320312	0.14
298.1084595	0.56
299.3137207	0.23
302.0769043	1.06
303.1600342	0.48
307.2443848	0.16
310.1428223	3.97
311.1695557	3.52
312.1636353	0.13
326.9423218	0.13
336.0876465	0.42
341.2098389	0.87
342.0831909	7.77
343.1203613	100.00
344.1606445	5.08
345.2045898	0.32
354.1121216	0.80
355.3770142	0.60
369.2380981	0.15
371.9791260	0.42
373.2959595	0.18
376.1270752	1.14
383.2817993	0.30
384.0744019	0.16
385.3155518	0.40
386.2846680	0.52
387.2421875	0.13
403.6423950	0.09
416.1018066	0.09
416.7872925	0.35
418.3067017	0.15
429.2453613	0.84
430.1628418	0.12
453.2530518	0.66
454.2441406	0.84
458.0093384	0.07
458.9299927	0.08
468.2775269	0.13
471.0971680	11.27
472.2324219	2.69
479.2561035	0.25
484.7660522	0.54
486.9153442	0.24
488.1058960	0.14
495.5290527	0.24
497.0126953	12.26
498.0900879	2.90
501.2014160	0.06
503.1585083	3.95
504.2312012	0.99
515.0197144	2.27
516.1668091	0.40
521.9707642	0.26
523.0690308	0.27
523.7187500	0.05
527.4695435	0.08
528.3507690	0.27
540.5112915	0.41
541.3341064	0.08
545.1560669	0.09
546.1895142	1.01
547.0790405	0.22
558.4312134	0.52
559.2709961	1.85
569.2326050	0.05
587.0645752	0.07
588.1824341	0.21
589.5252075	0.22
596.2094727	0.07
614.1164551	10.09
615.2482300	11.92
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	294.15
Annotation	N-(1-Deoxy-1-fructosyl)leucine
Peak:m/z	Relative Intensity
85.1876373	0.22
132.1720123	0.38
188.8421478	0.31
203.8450623	0.63
216.0628967	0.66
220.4127502	0.20
248.0894775	0.79
249.1378174	0.43
258.2123718	0.64
276.1766052	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.07
Annotation	7-Hydroxy-3-Methylflavone
Peak:m/z	Relative Intensity
96.74943542	7.34
98.71432495	14.79
123.1225891	6.94
127.0633087	7.01
139.1035004	15.23
147.1256561	5.11
149.1480713	15.69
153.3219452	9.22
159.0473785	5.42
161.213028	7.94
164.8606415	3.87
179.2147217	11.33
183.2263336	5.42
188.8888397	19.94
190.8879089	31.91
193.0269012	6.66
193.9346619	8.56
195.1833191	8.32
206.1444702	17.35
207.1722565	51.52
208.2960663	4.17
209.1746979	70.28
222.2715454	6.66
223.2595825	27.08
233.010788	31.29
235.2110443	19.32
251.0769806	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	303.05
Annotation	Bracteatin
Peak:m/z	Relative Intensity
93.0352478	0.27
109.0186691	0.49
110.9094009	4.62
121.0013885	4.40
121.9385147	0.71
123.1247025	1.34
123.9382477	0.48
126.9472733	0.51
137.0167847	14.67
138.0333405	1.03
145.1289978	0.30
146.1458740	0.50
146.9544067	0.18
148.9989929	5.83
149.9482422	0.68
152.9958191	11.64
154.0127869	0.26
157.3134766	1.89
161.0925903	2.24
162.0595398	0.71
163.0158997	1.59
165.0227356	43.62
166.0296936	6.59
173.0612183	1.92
174.0154419	0.74
177.0558624	0.56
183.1210327	0.41
185.1928864	0.52
185.9819946	0.18
187.0913239	0.59
191.1981201	0.81
192.1869202	0.86
193.1896973	0.98
195.1192017	4.78
196.3270721	0.47
201.1044006	5.71
202.1528015	1.72
203.2628479	0.24
205.1141357	0.93
207.1197815	0.92
211.1091919	0.89
212.1140747	0.60
213.2155762	4.01
214.0545349	0.49
215.0861511	4.00
219.2087097	5.03
220.1406250	0.35
229.1512451	60.35
230.0744629	8.80
233.1849365	0.50
234.0531006	0.30
239.0569153	2.25
240.9562988	1.69
241.9743652	0.31
247.0730896	25.79
248.1702881	4.96
257.0856934	100.00
258.1464844	16.59
259.3533325	0.62
260.1296997	0.25
260.8902588	0.35
262.0986023	0.91
267.2569580	1.21
271.3736572	0.14
274.0615234	12.87
275.2017822	9.71
276.0918579	0.21
284.1051636	1.00
285.1767578	49.99
286.1464539	14.04
303.1346130	20.87
303.9046021	1.39
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	289.0866
Annotation	N-gamma-Glutamyl-S-allylcysteine
Peak:m/z	Relative Intensity
86.1978302	0.20
88.0005112	0.04
126.0528717	0.25
127.9473724	100.00
128.5846252	0.35
153.1105652	2.29
159.9617004	2.04
161.8601532	0.21
167.0681152	0.07
170.9973907	15.07
179.1104889	1.00
197.0517883	0.82
215.1287842	15.22
253.0164185	2.04
260.2295532	0.13
271.0837097	20.22
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
323.0278320	0.03
341.1437988	0.18
342.0422974	0.05
383.3194580	0.33
384.2950439	0.06
425.9013062	0.02
443.1202393	0.04
485.2160645	0.08
486.5157471	0.07
502.7839355	0.07
503.3965454	0.05
504.2576904	0.21
523.4852905	0.04
539.3551636	0.05
540.9409180	0.02
545.4461060	0.19
546.4433594	0.03
647.3635864	0.10
648.6305542	0.03
665.5712280	0.17
666.3460083	0.24
667.4800415	0.24
707.3555298	0.19
708.3696899	0.10
709.4577026	0.18
768.1740112	0.03
827.3972778	52.23
828.3777466	100.00
829.4885254	17.59
875.3581543	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1191.3376
Annotation	Henryoside
Peak:m/z	Relative Intensity
363.2757568	0.94
469.6773071	0.10
525.2164917	5.08
543.2678833	3.94
687.4161377	11.59
705.3377075	18.41
706.0079346	0.08
777.4846191	0.21
807.7200317	0.07
849.4005127	8.87
850.1049805	0.04
867.5015869	100.00
939.3316650	0.23
1011.4985350	15.68
1029.4633790	70.30
1030.1977540	0.25
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
87.7386017	0.19
89.0190125	1.97
109.0834579	0.48
118.1416473	0.24
126.0201035	0.25
127.9542389	100.00
135.1614380	0.61
151.2276917	0.09
153.0942383	9.63
158.8857422	0.32
167.0396729	0.08
169.0425568	2.77
171.1253662	56.86
176.0285339	19.69
179.1294556	4.49
183.2533112	0.11
185.0713959	0.56
197.1217499	3.30
203.2170410	0.42
213.3468018	0.06
215.0482483	58.93
225.0127258	0.08
229.0952454	21.59
231.2720032	0.12
245.9772949	0.22
246.8441772	1.45
264.1300659	17.95
269.0226440	1.04
287.1425476	55.85
405.7895813	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	435.1292
Annotation	Monnieraside III
Peak:m/z	Relative Intensity
126.9269638	0.17
143.0137634	0.19
144.2446747	0.12
146.1382446	0.07
171.2869873	0.11
179.1064758	0.27
184.8784485	0.50
210.2428284	0.08
218.1651917	0.06
227.0570221	0.08
254.1285706	2.82
255.2795410	0.70
267.1717529	0.07
269.2600098	0.20
272.0597534	2.06
273.2971497	0.37
285.1846008	0.06
287.0088501	0.12
291.1575623	0.29
297.6290894	0.12
305.2794800	0.30
312.7132263	0.28
313.4077148	0.11
315.2458801	100.00
327.0938110	1.45
339.1174927	0.24
343.3904419	0.07
345.2367859	7.85
349.0050659	0.13
352.3922729	0.17
353.2014160	0.09
357.1109314	0.09
358.3511047	0.09
361.0571289	0.16
370.3892517	0.11
373.5192566	0.14
375.3367310	0.14
387.2191467	0.53
388.2618713	0.81
389.1857605	0.52
390.8650818	0.48
391.5388794	0.24
397.3265991	0.80
399.1290588	1.19
407.5690002	0.10
411.8655090	0.27
415.1097412	0.08
416.4780884	2.68
417.3747253	3.83
419.5967712	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	463.0885
Annotation	6-Hydroxytricetin 5-rhamnoside
Peak:m/z	Relative Intensity
135.0088501	0.01
149.1888733	0.00
150.9748840	0.60
163.1548615	0.03
165.0774994	0.01
168.9800873	0.03
179.1003723	0.93
186.9171753	0.01
189.1529236	0.08
190.0396729	0.01
192.1824341	0.03
193.0173187	0.02
196.9739380	0.02
203.1457825	0.01
207.1659851	0.05
213.1993408	0.04
217.1476135	0.12
219.1205750	0.03
221.2728271	0.03
225.1447296	0.01
227.0758667	0.04
229.2078247	0.03
231.2130737	0.03
233.2665100	0.04
245.2550659	0.06
253.2330933	0.03
255.1058960	0.28
257.1445312	0.08
266.0619507	0.03
270.3350525	0.03
271.1523743	0.22
272.1323242	0.01
273.1544800	0.20
274.9583740	0.01
281.0393066	0.05
283.0058594	0.09
283.6209717	0.06
284.3433533	0.02
287.4239502	0.02
296.3020935	0.02
297.2633667	0.06
300.0948792	14.36
301.0877380	100.00
301.9849854	0.05
309.0952148	0.05
311.0712585	0.03
313.4755554	0.04
315.4554138	0.01
319.0730286	0.02
325.5713196	0.14
327.2227173	0.13
329.2130737	0.06
331.1399536	0.03
337.3110352	0.18
343.1585693	1.61
353.2878113	0.03
354.2166138	0.02
355.0613098	0.09
359.1085510	0.01
366.9536743	0.02
372.5796204	0.03
373.2192688	0.18
385.0620117	0.06
395.2328796	0.06
419.3518372	0.02
443.9346313	0.01
445.3440857	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	827.2689
Annotation	Lantanose A
Peak:m/z	Relative Intensity
233.4186096	0.29
244.8820648	0.07
250.4251862	0.18
257.2910767	0.14
265.1492920	0.05
275.0093079	0.42
275.6111755	0.09
281.1276245	0.05
305.5013123	0.06
317.2543945	0.08
323.2485657	3.27
341.1329346	4.63
371.2206421	0.19
383.2539062	20.27
393.2338867	0.15
395.2155762	0.32
413.2731934	0.20
425.0458374	0.11
432.2686768	0.13
437.5252686	0.07
443.1355591	0.25
461.3388672	0.13
467.2697144	0.06
479.1899414	0.28
485.3797607	9.99
503.2760620	9.04
509.5319824	0.25
521.3623047	0.08
545.3564453	100.00
555.4324951	0.11
557.1492310	0.19
569.4650879	1.14
573.0978394	0.09
574.7777710	0.55
575.4664917	0.21
577.4845581	0.15
586.6796265	0.09
587.3292847	0.27
604.2081909	0.07
604.9396362	0.12
647.3159790	11.65
665.3688965	18.29
666.1770020	0.10
707.1810303	0.91
719.5150757	0.17
737.3075562	0.09
808.2441406	0.07
809.5154419	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	452.2783
Annotation	PE(16:0/0:0)
Peak:m/z	Relative Intensity
152.9357758	0.13
183.1316528	0.06
196.1615295	1.26
214.0191650	1.20
224.9772491	0.03
248.0536804	0.26
255.2916260	100.00
265.4909668	0.11
283.1959229	0.15
285.5524292	0.21
337.6140137	0.08
349.7896423	0.14
352.1932373	0.05
371.6852112	0.05
375.0048218	0.07
376.5322571	0.08
386.2803650	0.10
389.3460388	0.14
391.5368958	0.35
395.5097961	0.12
406.4898376	0.07
407.7153015	0.06
408.4122009	0.10
433.8339233	0.47
435.3097229	0.16
452.1589966	0.25
454.0563354	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	558.09
Annotation	Unknow
Peak:m/z	Relative Intensity
192.2518921	1.58
226.0063629	2.68
226.7296143	0.45
227.3393860	0.68
230.0260315	2.47
238.1009521	10.19
239.1412964	9.91
240.1050873	0.60
249.1543579	0.33
255.8799438	1.35
256.8970642	7.00
257.8924561	2.85
264.9801331	17.20
266.2313843	9.55
267.0579834	4.29
274.1146851	49.01
275.0822754	37.53
276.0496216	15.81
277.2860718	1.19
306.1251221	3.51
348.1702271	0.52
377.9896240	8.77
392.1492310	2.21
395.9503174	34.96
428.2564087	0.69
464.2116699	0.96
468.0251465	0.92
472.3841553	3.01
473.3267212	17.35
474.2177734	10.30
503.2509155	12.89
504.2095337	2.23
521.3087769	17.10
522.5621948	0.85
539.2285767	100.00
540.2655029	41.82
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	408.14
Annotation	gamma-L-Glutamyl-gamma-L-glutamyl-L-methionine
Peak:m/z	Relative Intensity
133.9924927	0.23
136.2520752	0.32
144.1242065	0.31
150.7455750	0.28
157.8748474	0.15
162.2417297	0.33
175.9899292	4.25
214.8112488	0.28
243.9956360	3.29
253.4187622	0.12
261.1770020	7.58
262.0421448	7.09
267.2319031	0.23
272.0974731	0.42
279.1573792	100.00
301.8982544	0.97
305.0782471	0.88
329.3037109	0.26
333.0641785	1.87
336.2296448	0.15
345.5522156	0.55
349.1716614	0.39
354.9912720	0.21
361.9152527	1.26
389.4960632	0.19
390.1762085	0.84
391.5995178	0.33
394.1370239	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	337.1053
Annotation	Musanolone D
Peak:m/z	Relative Intensity
99.0406189	0.02
114.9105988	0.04
115.9721527	0.05
118.9514542	2.84
127.0376282	0.01
129.3657227	0.03
130.0471954	0.03
143.9281006	0.07
144.7979889	0.04
162.0620422	1.35
171.9348450	0.14
175.2427216	0.05
190.1182098	3.14
190.9559784	19.23
201.4259033	0.02
203.0473938	0.03
208.0133209	100.00
208.8268433	0.03
217.4612732	0.05
235.3409119	0.07
274.1094666	1.59
277.1456909	0.05
291.0969238	0.05
293.2828064	0.04
304.9242554	0.04
309.4828491	0.04
319.2347107	1.36
320.1295776	2.17
328.2561951	0.06
329.4631042	0.02
335.2804871	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	549.1672
Annotation	Galactotriose
Peak:m/z	Relative Intensity
322.9811401	0.02
338.4591064	0.01
341.1656494	0.02
386.4281006	0.01
387.2966919	0.06
414.1624756	0.02
503.2622681	100.00
549.4420166	0.01
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
94.94416809	0.53
96.84996033	0.79
98.73570251	0.56
104.9314575	0.52
106.9876328	0.26
109.0615005	0.55
112.9489899	0.26
114.8589935	0.31
122.7548828	1.12
125.1596527	0.66
126.8520737	0.27
128.9461365	0.57
131.0077667	0.23
133.1248169	0.53
137.1724548	0.77
137.8262177	0.33
139.087616	3.32
140.9922485	1.05
142.9829865	0.59
146.874115	0.36
148.9900208	1.11
150.1137848	0.59
153.0774231	0.33
155.1566772	0.35
158.0525208	0.32
160.5559387	0.64
162.3049469	0.17
163.1519623	0.65
167.1070557	1.83
168.980072	2.36
171.0740967	0.64
172.9055786	0.58
174.9772949	0.29
177.0941772	1.30
180.9319611	1.12
183.0048676	0.84
183.798996	0.38
184.9595184	0.62
191.0002594	1.36
195.0951843	4.40
197.2456665	2.94
199.2971497	0.85
203.2573547	0.31
205.1126099	2.17
207.1990356	0.29
211.0647583	2.49
212.0695496	0.55
213.2366638	0.79
215.2743835	0.83
219.2833862	1.04
221.1955261	1.20
222.714447	0.86
223.9148254	0.49
225.0771179	1.10
227.0904541	1.70
230.6277466	1.14
233.2275085	2.05
235.0716553	0.61
236.9229736	1.08
239.1635132	1.82
241.3071899	1.10
247.4242859	0.24
249.3618164	0.92
251.2848816	2.18
253.2550964	8.85
254.7429199	1.10
257.3095703	0.19
264.3118591	0.81
265.2667847	2.94
267.3701172	0.93
268.5261536	0.89
270.3121643	0.76
273.3028564	0.35
275.319458	23.48
280.4578552	0.70
282.5525208	1.78
283.3659973	2.17
291.8898315	0.35
293.2044678	100.00
293.9996338	0.52
302.4932861	0.81
309.9360352	0.31
319.3025818	0.73
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	609.1456
Annotation	Isoorientin 6''-O-glucoside
Peak:m/z	Relative Intensity
173.0538025	0.01
174.1029358	0.02
175.0949402	0.02
179.0774384	0.08
180.0016937	0.02
182.2373657	0.13
183.0630493	0.03
185.2073212	0.04
186.3342590	0.05
187.2577820	0.05
189.0404358	0.04
191.2369843	0.02
191.9329987	0.06
193.0630188	0.04
195.1545410	0.05
196.2285461	0.02
197.0526886	0.11
198.4757538	0.08
199.2399597	0.10
200.1318970	0.09
201.1838379	0.02
202.3990479	0.01
205.1078796	0.08
209.1407471	0.05
211.2611694	0.07
212.6124878	0.07
213.2256470	0.44
214.1208649	0.03
215.1628723	0.07
216.2750092	0.01
217.2104950	0.08
219.1688538	0.03
222.6603699	0.06
223.3178711	0.03
225.4304504	0.07
227.1024170	0.09
228.2260895	0.02
229.2202148	0.45
230.2087708	0.15
231.0761414	0.08
233.1671753	0.02
235.2991180	0.03
237.1120453	0.07
239.1333466	0.19
240.2803345	0.09
241.2410736	0.73
242.4242554	0.04
243.1537018	0.11
245.3445129	0.04
253.1993713	0.09
254.0948181	0.09
255.1002350	1.86
256.1625061	0.45
257.1629944	2.19
258.2200928	0.19
259.4197998	0.09
265.1459656	0.13
266.3950500	0.02
267.2707520	0.11
267.9748535	0.01
269.1816406	0.15
270.2963257	0.06
272.6217651	0.02
273.2354736	0.03
275.2090454	0.11
276.1975098	0.03
279.1766357	0.01
280.1859741	0.02
281.2432251	0.47
283.1651001	8.26
284.3739014	8.54
285.1323853	100.00
286.1991272	13.63
287.3196106	0.06
293.3112183	0.07
294.2734070	0.01
295.2275391	0.08
296.6125488	0.17
297.3970032	0.10
298.2926025	0.47
299.2045898	1.32
300.2640381	0.19
301.2251587	0.01
303.2554016	0.06
306.2125244	0.01
307.2410889	0.11
308.1729431	0.02
309.2739258	0.04
310.5968323	0.01
312.9063110	0.04
313.6788330	0.02
319.2344360	0.04
321.2898865	0.01
322.1809692	0.01
324.2685242	0.03
325.2313843	0.16
327.1401978	4.56
328.1815186	0.94
334.7886963	0.02
341.2722168	0.05
342.3408203	0.02
350.2505493	0.01
351.2167358	0.04
352.2731323	0.11
357.1630249	0.54
358.0482178	0.06
359.1962280	0.02
361.2482910	0.03
364.2293701	0.01
365.1952515	0.02
366.1057129	0.03
369.0036011	0.14
377.4097900	0.01
379.3422241	0.15
380.3583374	0.08
401.5898438	0.06
403.3725586	0.08
411.5060425	0.02
416.4931030	0.01
418.0908813	0.08
419.3116455	0.34
420.3091431	0.07
429.4000244	0.05
431.2681885	0.13
435.0676270	0.02
443.3743286	0.04
446.3692017	25.76
447.2578125	61.06
448.2166138	13.83
449.1062012	0.09
457.4697876	0.03
461.2188721	0.39
462.3104858	0.08
471.3090210	0.02
473.6665649	0.03
479.3789062	0.03
489.2794189	6.10
490.3532104	1.51
492.3914795	0.03
501.2058105	0.01
519.3515015	0.18
520.3845825	0.13
531.5026245	0.02
532.5291138	0.01
536.6518555	0.02
547.2238159	0.01
565.2196655	0.01
581.3170166	5.88
582.3988647	2.04
591.2724609	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	396.088
Annotation	Unknow
Peak:m/z	Relative Intensity
116.9884491	0.46
151.1504364	0.31
160.0939941	2.45
162.0685120	1.43
163.9150085	0.65
172.0247803	0.14
172.9960785	0.51
177.0477295	15.24
198.4664307	0.72
199.2527466	0.25
203.0314026	0.50
217.2511749	1.74
230.0009155	1.28
230.9611511	1.14
232.1986694	0.24
234.1231995	0.35
235.9529114	0.11
240.8546143	0.27
247.8519592	3.39
248.9597168	4.87
250.1264648	3.75
262.7846375	0.24
264.4824829	0.87
265.1164551	23.12
266.0686646	36.80
267.1610413	42.30
274.0777283	0.39
288.0688782	0.85
293.9556885	0.49
306.1246338	100.00
313.1394958	0.58
315.1084290	0.25
319.1646729	0.52
320.1680908	1.43
321.0234375	1.47
322.1853027	0.22
323.8648071	0.40
331.1578369	0.16
333.2014771	0.37
336.2902832	0.23
340.3058472	0.47
350.0843201	0.15
354.2563782	0.43
355.4396057	0.47
359.2456665	0.22
360.2528992	0.86
365.3987122	0.55
367.2589722	0.38
368.1106262	0.27
375.2877808	0.41
377.4128723	2.54
378.2240295	1.64
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	481.1
Annotation	Unknow
Peak:m/z	Relative Intensity
171.0899658	0.23
177.0201111	0.08
181.0344696	0.49
184.1415100	0.13
199.0022278	0.61
206.0801239	0.06
223.0668335	0.15
231.0874786	0.80
257.2317200	0.16
265.1556702	0.48
288.8949890	0.04
300.7805481	0.04
306.2513428	0.57
307.1602783	0.13
317.2428589	0.36
324.1879578	0.24
334.1991577	1.60
335.1111450	2.54
352.1168518	100.00
363.2543030	0.08
390.8306580	0.02
407.5410767	0.10
418.0812683	0.16
420.0348816	0.18
434.2278137	0.26
435.4716797	0.20
439.2239685	0.07
463.2335510	8.71
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	347.216
Annotation	Unknow
Peak:m/z	Relative Intensity
112.9596100	0.05
118.0436401	0.13
131.0018921	10.31
137.1158447	0.04
138.3625488	0.07
146.2175446	0.04
153.4984131	0.59
154.1183472	3.83
156.0700073	1.10
173.0513916	100.00
199.0631104	0.13
200.0923157	0.05
200.7488098	0.12
201.3592529	0.05
210.0503845	0.51
218.1678772	0.10
228.2199707	0.06
231.0868225	0.23
231.9306335	0.06
242.1902771	0.04
246.2398376	0.24
258.9520264	0.21
273.2298584	0.04
275.3390808	0.08
300.2419739	0.17
301.2407227	0.47
303.2767334	0.48
312.4439697	0.06
316.3107910	0.69
317.3545227	0.09
326.3294067	0.23
327.1938477	0.06
328.4155273	1.12
329.2366943	4.98
330.2684937	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	865.2448
Annotation	Unknow
Peak:m/z	Relative Intensity
381.0402832	2.05
525.3306885	10.15
543.4121094	18.24
661.1531372	0.33
687.4879150	7.84
705.4531860	100.00
723.5379028	0.96
817.4234009	0.29
849.7789917	0.37
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	295.095
Annotation	gamma-L-Glutamyl-L-methionine sulfoxide
Peak:m/z	Relative Intensity
102.1307373	0.05
103.1001282	0.19
115.1509323	0.03
117.0011444	0.08
120.0757523	0.06
123.1155548	0.20
127.0760956	0.06
130.7958069	0.64
138.2861938	0.08
139.9025574	0.06
147.9141846	0.49
149.0309753	4.10
166.0496216	100.00
167.2234192	0.13
175.1773834	0.06
179.2214355	0.08
185.1166687	0.09
195.2957458	0.11
201.0805054	0.12
204.6465454	0.15
219.2358398	0.04
221.2988892	0.04
223.1738281	0.05
231.1086426	0.97
232.1019592	2.06
233.1766663	0.22
234.8829651	0.04
235.9635010	0.14
237.2893982	0.15
247.2485657	0.08
248.2745667	0.11
249.0668640	0.96
250.0258789	0.22
251.2147217	0.09
258.9006958	0.76
264.8746338	0.09
267.0560303	0.04
272.3035583	0.24
276.3038635	2.81
277.1625977	12.19
278.0764465	0.69
285.7420044	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	379.09
Annotation	Unknow
Peak:m/z	Relative Intensity
145.0181580	0.15
162.9251404	0.52
172.8325958	0.21
175.0024109	0.63
182.8289337	0.13
184.6617737	0.36
199.1486664	0.69
208.0845184	2.12
217.1346436	0.22
220.7742310	0.21
231.0109558	0.52
235.1681519	0.73
243.0184937	0.22
253.2327271	0.74
255.0325623	0.25
258.1272278	0.67
259.3173828	0.93
271.0541687	0.76
275.0558167	0.62
277.1322632	1.17
280.0886841	3.41
287.3142700	0.25
288.9851685	100.00
290.4743958	2.37
293.1194763	0.37
295.1838989	0.81
298.1569824	2.96
301.1160583	0.43
305.3871765	0.42
306.5461731	0.46
319.0844727	0.49
320.9311523	0.16
330.8814087	0.68
332.3493347	0.28
333.2738037	1.59
343.5609436	0.18
349.1509094	0.25
354.9082947	2.85
360.8450623	7.04
361.5064087	1.58
378.6468811	0.59
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	586.91
Annotation	Unknow
Peak:m/z	Relative Intensity
202.8110962	0.04
273.0672607	0.91
274.1386108	0.07
358.9743042	0.33
385.3037109	0.13
387.0021362	0.25
388.0812988	0.19
388.9287720	0.05
403.0672607	0.14
404.1161499	0.21
405.0859985	0.09
422.0491333	0.06
427.1361084	4.28
429.1533813	0.39
443.3160400	0.14
447.1432495	0.04
450.9260864	0.10
455.1925049	0.28
457.1087646	0.09
470.0562134	0.10
471.0449219	0.58
472.0675659	1.01
473.0159302	4.00
475.2997437	0.10
484.8188477	0.39
494.5537720	0.13
496.1414185	0.04
502.0858154	0.12
502.8981323	0.17
511.2953491	0.09
513.0540161	0.35
514.3170166	0.13
517.9098511	0.29
525.2553711	0.22
529.1292725	0.27
531.2242432	0.23
540.8960571	100.00
541.8317261	0.83
542.9504395	0.85
543.9775391	0.05
557.0254517	0.20
558.0202026	0.15
559.1724854	0.35
560.9229126	0.23
568.1206665	0.37
569.1397095	0.36
576.9829712	0.11
580.5935059	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	392.11
Annotation	(gamma-Glutamyl-gamma-glutamyl)-S-methylcysteine
Peak:m/z	Relative Intensity
126.1871185	0.05
128.0493164	2.87
135.1396790	0.23
139.0019531	0.05
141.2473907	0.14
143.0713501	6.19
144.1100616	0.06
145.1683350	0.60
146.0516205	0.63
153.1871338	0.08
155.0655365	0.03
160.0530090	0.26
166.3144226	0.16
167.1303101	0.42
169.0795288	0.11
170.0845032	0.10
171.2132111	0.18
177.0763550	0.70
179.0589905	7.34
180.7534180	0.03
185.0574951	0.22
192.0628052	0.08
197.1100464	0.79
198.9541626	0.07
210.2060242	4.55
228.1242371	0.54
231.2691956	0.07
236.1780090	0.36
254.1508484	71.08
259.9572754	0.05
263.1775818	5.51
272.2279053	100.00
288.1667175	5.83
289.2422485	0.13
306.1949463	49.63
317.2928162	0.06
374.2377014	18.94
375.3110352	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	456.06
Annotation	Unknow
Peak:m/z	Relative Intensity
136.8178711	1.04
144.9027252	0.57
147.2198944	0.42
156.0100098	2.58
168.7397003	1.11
197.1131287	0.36
211.1550903	0.87
214.1889343	0.18
219.9239502	0.31
226.3904572	0.14
227.1582184	0.65
240.9288025	0.21
242.9547119	1.04
247.1909790	0.91
250.2625122	0.18
258.1277771	0.24
258.7758484	0.28
260.1472473	10.54
261.0643616	2.54
261.9173889	3.45
274.1748047	0.30
291.0966797	0.60
291.8879395	0.24
293.0203857	0.24
294.2678223	0.44
295.2557373	0.25
297.2330017	0.29
301.0953979	0.48
302.2180176	2.82
311.3374023	0.14
316.3877563	0.30
320.2282104	0.44
326.8285217	1.01
332.2645264	0.71
333.1382751	0.38
361.3728027	0.25
364.1379089	6.44
365.1827698	0.35
366.2238770	0.52
367.3106384	0.30
376.2068787	0.27
382.5417786	0.76
383.1570740	0.27
392.3545227	0.72
397.3799133	0.76
416.4924927	1.74
419.2117004	1.14
419.9961243	0.33
423.2612000	0.22
427.4458618	0.25
438.1629333	100.00
450.9930725	0.22
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
112.2252426	0.16
113.0221024	0.24
121.8818436	0.81
130.0639954	2.40
165.4031982	0.35
166.1639709	0.90
177.0336761	4.82
181.1315002	0.20
182.3653107	0.07
207.9693298	14.16
223.2419739	0.43
225.0747375	100.00
227.9283447	0.18
243.0156860	0.20
261.1102295	1.75
263.6011963	0.07
264.3829956	0.30
269.4470825	0.08
272.5623779	0.09
279.1510620	9.20
283.2963257	0.34
288.2749634	0.11
291.2410583	0.54
309.6095581	0.74
311.9784546	0.21
313.2172852	0.23
318.2111816	0.40
323.3662720	0.10
331.3167114	0.14
335.7547607	1.62
336.5329285	0.77
337.2628174	0.30
345.3418884	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	447.093
Annotation	Luteolin 5-glucoside
Peak:m/z	Relative Intensity
150.9759521	1.38
152.0319977	0.20
163.0422821	0.03
164.9371033	0.03
179.0198517	0.16
185.2769775	0.01
193.0078430	0.06
196.3026733	0.02
197.3013611	0.02
198.7157898	0.03
200.1513519	0.04
212.6044769	0.07
213.2065582	0.17
214.3294220	0.03
218.3708496	0.04
229.1150208	0.03
240.4226990	0.04
241.1126709	0.18
242.2888794	0.14
255.1435242	0.06
257.1995239	0.72
258.3130188	0.25
267.0184326	0.04
269.2095947	0.09
270.3079834	0.04
271.2934570	0.06
281.1446533	0.09
284.1085815	6.86
285.1290283	100.00
286.1276550	23.71
297.0435181	0.04
298.1169128	0.56
299.1330872	0.24
300.3753052	0.03
301.3820190	0.01
307.3115234	0.15
308.3484497	0.02
310.1390076	0.03
319.2079163	0.03
321.1829224	0.03
325.1698608	0.02
327.1359558	3.14
328.1652527	0.56
339.2956543	0.02
350.9203491	0.04
352.4547119	0.02
357.4359741	0.12
381.3302917	0.02
383.5763855	0.05
387.4129944	0.04
388.1719055	0.03
393.3071594	0.01
400.4063110	0.01
402.1145935	0.03
404.1435547	0.04
420.2739563	0.01
429.9436340	0.14
430.5542908	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	787.1929
Annotation	Myricetin 3-rutinoside-7-glucoside
Peak:m/z	Relative Intensity
301.0955200	0.27
341.3276367	0.07
343.4096680	0.02
356.3256836	0.06
463.2939453	9.21
464.2798462	1.06
466.0247803	0.03
521.0319824	0.04
547.4220581	0.03
576.7357788	0.04
604.0020752	0.01
619.6837158	0.06
625.2717896	100.00
626.2050781	5.63
626.8687134	0.27
659.2452393	0.03
697.3596802	0.15
703.7913208	0.02
711.5370483	0.02
740.8132935	0.04
745.4509888	0.05
751.0714722	0.02
769.3181763	0.22
770.4557495	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	311.221
Annotation	trans-EKODE-(E)-Ib
Peak:m/z	Relative Intensity
93.05282593	0.29
98.88027954	0.30
109.097229	0.52
118.3860703	0.16
120.9529877	0.78
122.8414612	1.87
126.9187012	0.86
128.1130371	0.35
129.0443726	0.25
131.0726929	0.44
133.1101837	0.49
135.2150726	0.30
136.8305664	0.89
139.1051941	1.15
141.1184998	1.05
143.202179	1.49
146.5366669	0.29
148.9570312	1.55
151.1329346	1.47
153.0677032	1.16
155.1208954	1.36
155.9250946	0.17
157.0451355	2.84
161.0450134	0.49
163.1177521	0.63
167.1358337	1.24
169.0209808	1.85
169.9481964	0.12
171.1854858	1.91
175.0282898	1.17
177.1679993	0.22
179.0623627	1.46
180.9720764	1.66
183.1853485	1.22
183.9731598	0.23
185.0699768	0.12
187.055069	1.88
188.9805908	1.10
191.1932831	1.13
193.1453247	0.68
195.1387024	2.97
197.1504211	1.15
199.2121735	1.26
201.3262939	0.27
205.0391235	0.26
207.3256531	0.43
208.427887	0.30
209.2146301	0.90
211.1195068	5.03
213.1237488	1.35
215.296051	2.69
217.0246582	0.84
222.0858765	0.53
223.1670837	2.79
225.2829285	1.41
226.0705566	0.37
226.9563599	1.22
229.262085	2.71
233.1723633	2.31
234.0806274	1.66
235.2588501	1.72
236.0815735	0.59
237.0935364	4.71
237.7314148	0.87
239.1299133	1.57
240.5863647	1.45
241.2439575	0.87
242.9428711	0.43
245.3651123	0.29
247.3842773	1.21
249.4170837	0.49
251.0884399	0.61
253.0487061	11.39
255.2663574	0.50
258.1973877	0.60
263.1719666	1.25
265.3080139	2.79
266.7643127	1.42
267.3685303	0.77
268.2903442	1.47
269.4172668	2.72
270.7236633	0.99
275.2175903	14.41
277.1716919	0.46
281.2316284	0.39
283.2796631	5.07
288.1816406	0.83
293.2027893	100.00
294.4131165	1.61
296.2784424	0.28
299.3499451	1.20
301.9320679	3.81
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	342.2993
Annotation	N-palmitoyl GABA
Peak:m/z	Relative Intensity
103.6815262	0.10
104.4777679	0.11
106.9089279	0.27
109.0757751	0.15
109.9980698	0.08
111.0386887	0.20
119.1475830	0.40
121.1768036	0.55
123.1827698	0.38
124.9859772	0.07
130.9625549	0.06
133.1708984	0.43
135.0703125	1.08
137.0420532	0.36
145.1774597	0.53
147.2077484	0.24
148.0344543	0.08
149.0404358	0.31
151.9092712	0.16
155.1125793	0.10
155.9199219	0.07
159.2045593	0.56
161.0420227	0.04
163.2353210	0.24
165.1058350	0.29
168.0431519	0.06
173.0769196	0.49
175.2714539	0.32
176.1570435	0.10
177.2786255	0.28
178.4750214	0.09
181.1615906	0.21
183.1138611	0.29
183.8165283	0.05
187.1857910	0.50
189.2299500	0.43
191.2663116	0.26
201.1895905	0.34
203.4005432	0.11
205.1023865	0.09
208.9020996	0.18
215.3252869	0.66
216.9898071	0.24
219.3379517	0.10
221.3253784	0.13
231.4918213	0.14
233.2587891	0.36
235.1227112	0.20
245.3773193	0.40
247.1793518	0.31
251.0413513	0.04
258.3405457	0.20
259.2621460	0.44
261.2724915	0.27
262.4507751	0.16
263.2500610	0.10
264.2097778	0.05
268.4928589	0.14
271.3730469	1.83
276.3929443	0.35
277.3768311	1.41
278.7176208	0.10
288.4064941	1.42
289.4590759	1.63
294.3955994	0.40
304.2525024	0.26
304.8591919	0.18
306.3957825	46.78
307.3405151	0.11
324.3661499	100.00
325.1028442	0.23
325.7525024	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	311.2215
Annotation	trans-EKODE-(E)-Ib
Peak:m/z	Relative Intensity
97.18603516	0.72
104.7875519	0.31
106.960434	0.96
108.9587173	0.84
111.0699615	1.02
112.9601288	0.18
114.9410019	0.49
117.0885162	0.62
121.2622757	0.53
123.0940475	1.89
124.9975433	0.82
127.1419373	0.39
129.0270844	1.18
131.102005	0.23
133.3145752	0.84
135.0871277	0.50
139.1750183	1.05
141.267395	1.11
143.1529083	1.68
145.2832184	0.48
146.9173279	1.42
151.1975403	1.31
153.0879059	1.38
155.0251465	2.18
155.9341736	1.09
157.1928101	0.24
159.4600525	0.31
161.1735992	1.00
162.8404846	1.55
165.1272278	0.23
167.407196	1.04
169.0448761	0.79
176.8827362	0.25
181.0768585	2.07
183.2498016	1.44
185.2113342	1.27
187.4199677	0.58
189.0879517	0.31
191.0744781	1.36
193.2311554	0.98
195.2032471	3.94
196.319931	0.46
197.1764984	2.37
198.9668732	0.44
201.127594	0.18
205.2268982	1.54
209.3057251	0.78
211.2076111	2.32
213.1626892	0.60
215.3208313	0.78
216.2684021	0.90
217.1046448	0.71
219.3332214	0.57
221.144989	1.99
225.1371155	1.99
227.1573181	1.06
228.3403015	0.19
231.028656	0.51
233.011322	0.43
234.97995	1.11
236.8511963	0.23
239.0794678	0.94
241.2920532	0.23
247.135376	0.67
249.5387268	0.21
250.5311279	1.61
251.1729126	4.31
253.1439819	11.67
255.3962097	0.66
257.0867615	1.32
259.0516052	0.64
265.4039307	1.60
267.2263184	2.19
268.5923767	0.75
269.4133911	2.35
270.0643005	0.67
270.9941711	0.13
275.2341309	20.50
277.5088196	0.87
283.2870483	6.98
293.2038879	100.00
294.1946411	1.28
297.0567017	0.53
298.1335449	0.34
301.6030273	0.57
310.0565796	0.76
311.0955811	0.41
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	342.2994
Annotation	C-2 Ceramide
Peak:m/z	Relative Intensity
97.14943695	0.35
108.9095993	0.67
110.0568466	0.13
113.016037	0.44
115.0979156	0.28
120.8818665	1.08
123.0815125	0.49
124.1356964	0.27
124.9476318	0.48
125.9363632	0.34
131.103363	0.37
135.0219116	1.58
140.873703	0.30
142.043457	0.34
142.8602905	0.27
143.5013275	0.12
146.0716553	0.33
149.2277527	0.15
150.2524109	0.28
151.0146484	0.21
157.244751	0.14
161.2523193	0.51
163.0151672	0.17
170.3251343	0.77
171.0356293	0.27
173.2564087	0.49
174.9464417	0.22
183.0102997	0.13
183.9559631	0.26
187.2528687	0.25
189.1167603	1.42
191.1095734	0.60
193.3109283	0.98
195.0741882	0.23
200.1105499	0.20
203.9884644	0.10
205.2812805	0.65
206.4147797	0.43
210.9271545	0.47
222.1850586	0.56
224.2874756	0.23
231.104187	0.21
233.3179016	0.24
234.0032654	0.28
234.922821	0.12
236.1290894	0.14
243.4582214	0.17
245.3433838	0.89
246.3637695	0.61
247.2939758	1.64
248.4718933	0.79
252.1640015	0.56
254.3170776	0.64
255.2430725	0.12
257.1478271	0.21
260.4172363	0.29
261.3336182	0.14
263.2879028	1.58
264.9431152	1.03
268.3821106	0.91
271.4345703	2.92
275.6477661	0.22
276.3081055	0.38
279.0059509	0.32
283.1610718	0.69
285.3048096	0.41
286.3220215	0.92
289.237915	12.12
293.3144226	1.40
294.493103	0.78
295.4552612	0.79
296.388855	0.61
297.4234619	0.24
301.0012512	0.19
305.2670898	0.17
306.3163452	16.55
307.1433716	1.00
309.6890564	0.12
311.0969238	2.70
311.96875	0.61
312.6883545	0.42
324.2814331	100.00
325.2287903	1.24
340.2854004	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	259.0786
Annotation	4'-Hydroxyflurbiprofen
Peak:m/z	Relative Intensity
112.9745789	0.03
114.2426758	0.06
125.1438599	0.03
139.9734497	1.75
145.1587677	2.60
158.1754608	0.08
167.1136169	0.13
171.0307922	0.11
175.1292267	0.02
183.7885590	0.13
184.3918610	0.05
187.1238251	0.06
195.0732880	0.05
196.1070557	5.05
199.3683167	0.02
202.1041412	0.10
205.3375854	0.04
211.3231964	0.09
213.0438538	100.00
214.1019440	1.84
215.0987854	0.54
217.0245514	0.13
225.2355804	0.12
228.7169952	0.02
231.0755463	30.91
233.2545013	0.02
241.1358643	0.76
242.2352295	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.0358
Annotation	Unknow
Peak:m/z	Relative Intensity
210.8547058	0.33
212.8782043	11.44
215.0452881	0.34
251.1420898	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	449.1451
Annotation	Melampyroside
Peak:m/z	Relative Intensity
135.1015320	0.02
135.9215698	0.08
150.2003174	0.39
158.9531555	0.09
164.0490875	0.06
165.0341187	0.04
210.9885712	0.35
212.4614258	0.04
213.0752258	0.03
224.2187805	0.02
225.5401306	0.04
227.1974182	0.16
228.1409607	6.50
229.2462158	1.09
230.9041138	0.04
239.0905762	0.05
243.1602478	57.85
244.1658325	17.35
255.3128357	0.23
256.2207947	0.05
257.2390747	0.96
258.2855530	0.34
268.0681763	0.07
269.4023132	0.18
270.2962646	0.04
271.1110840	0.29
272.3770752	0.33
273.2124023	0.05
283.4448242	0.18
285.1286926	1.55
287.1936035	100.00
288.2070923	26.44
295.3279419	0.08
297.2949219	0.39
298.9785156	0.79
300.3303528	0.11
301.3221130	1.16
302.3040466	0.75
311.4303284	0.49
312.4682007	0.04
315.5510559	0.15
322.9731445	0.06
327.4171753	0.19
329.2186584	7.23
330.2396851	1.70
331.2098389	0.04
333.2249146	0.07
336.3904419	0.16
337.5121460	0.05
341.0440674	0.05
349.3862915	0.07
351.2688293	0.14
352.2096863	0.20
353.2112427	0.05
359.3182983	1.07
360.3269653	0.87
361.2874756	0.03
362.4594421	0.05
369.2521973	0.03
371.3610840	0.25
372.3727722	0.52
377.3005371	0.08
378.2408142	0.05
385.6018982	0.03
386.4389648	0.14
387.5602112	0.03
389.4677734	0.04
390.1656189	0.03
391.7098389	0.09
395.2087097	0.24
401.9447632	0.18
404.1511536	0.24
405.4585876	0.03
412.3915100	0.06
413.2901917	0.04
414.4724731	0.36
417.3264160	0.10
419.3518677	0.02
422.7640991	0.06
431.2648926	0.21
432.2702942	0.20
434.3200378	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	280.9924
Annotation	Unknow
Peak:m/z	Relative Intensity
153.0112000	0.15
189.0507202	0.27
195.0091248	0.08
224.2911987	0.10
234.2190247	0.15
235.2083435	0.15
237.0556641	0.08
239.8609009	100.00
240.5015564	0.16
249.2024536	0.18
249.8717957	0.08
252.9694519	0.26
257.4765625	4.65
258.1588135	0.25
263.2685547	0.23
264.8743286	0.09
272.3999329	0.34
280.5588074	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	523.34
Annotation	Unknow
Peak:m/z	Relative Intensity
175.0731354	2.45
196.0924530	0.35
213.1853638	0.97
233.1290588	0.24
349.0541992	100.00
386.8970337	3.07
403.1435547	0.51
408.0888672	0.16
427.3879395	0.20
438.8744507	0.17
439.8458252	0.09
487.3301392	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1376.9308
Annotation	Unknow
Peak:m/z	Relative Intensity
476.5869141	0.18
786.8398438	0.62
1447.1468510	0.16
1476.3342290	0.13
1525.7742920	0.13
1573.3780520	0.23
1683.5354000	0.11
1691.0693360	0.07
1693.6849370	0.76
1719.1557620	0.11
1738.0427250	0.10
1741.4678960	0.20
1746.9329830	0.46
1752.1768800	0.27
1766.6292720	0.35
1768.2235110	0.23
1769.5324710	0.28
1771.9593510	0.08
1777.7073970	0.39
1778.8171390	2.06
1782.5399170	0.11
1784.1029050	1.20
1784.7058110	0.12
1787.0028080	0.64
1792.0762940	0.17
1795.8665770	2.53
1798.3087160	0.12
1801.2961430	0.22
1805.5416260	0.75
1806.9406740	0.21
1816.4265140	0.42
1820.8668210	21.73
1821.7634280	0.20
1822.5054930	0.14
1827.8355710	0.14
1832.0660400	0.20
1833.2401120	0.07
1839.4114990	0.28
1840.6527100	1.50
1841.3664550	0.61
1844.0584720	2.01
1845.0819090	0.17
1846.8802490	1.87
1849.1765140	0.11
1852.6766360	0.47
1856.0916750	0.12
1857.3494870	0.06
1858.1356200	1.75
1859.1158450	1.37
1860.2093510	0.13
1862.1634520	0.66
1862.9957280	0.66
1867.7288820	0.25
1870.2667240	0.12
1872.3094480	0.38
1875.4436040	8.72
1876.6021730	0.22
1880.6080320	0.52
1882.0118410	0.12
1884.4533690	1.13
1885.0914310	0.08
1887.6263430	0.36
1888.8609620	0.50
1890.8312990	0.10
1891.8581540	9.82
1893.4001460	11.36
1894.3502200	0.15
1898.0213620	1.22
1899.6208500	0.52
1900.3674320	0.20
1901.6496580	0.22
1903.9924320	3.17
1906.0725100	0.14
1906.7886960	0.07
1907.6051030	0.13
1908.8116460	0.09
1909.8599850	0.49
1910.4958500	1.45
1911.3962400	1.21
1912.8326420	0.47
1913.9403080	0.52
1915.5032960	0.54
1916.1243900	0.75
1916.7608640	0.12
1917.6857910	0.49
1921.0271000	1.51
1923.5368650	25.21
1924.4967040	0.41
1925.2391360	0.35
1927.0275880	0.25
1929.3049320	0.47
1932.4268800	10.12
1933.8029790	0.54
1934.5192870	1.58
1935.2951660	0.48
1935.9080810	0.28
1937.0357670	0.94
1938.8980710	1.12
1939.8226320	1.64
1940.7503660	0.33
1941.9396970	0.08
1943.7376710	1.53
1944.3835450	0.50
1945.6158450	27.46
1947.2796630	1.92
1949.0184330	3.80
1950.2935790	0.36
1950.9874270	0.14
1952.0173340	0.37
1953.2808840	0.64
1954.2218020	0.08
1956.9616700	6.80
1958.2454830	0.56
1959.1348880	0.24
1960.3029790	3.40
1961.7395020	1.35
1962.4523930	8.27
1963.5523680	2.96
1964.7033690	0.50
1965.8497310	1.44
1967.2692870	0.15
1968.3936770	0.28
1969.2712400	0.28
1970.2647710	0.09
1971.2200930	0.97
1971.8575440	0.06
1973.3824460	4.68
1974.5197750	2.52
1975.4512940	0.90
1978.9403080	1.57
1980.2886960	5.61
1981.3160400	0.94
1982.5355220	0.33
1984.3182370	0.80
1985.5213620	0.66
1986.2604980	0.81
1987.3460690	0.61
1988.6842040	0.65
1989.7962650	0.26
1990.6755370	0.82
1991.4464110	100.00
1992.8918460	6.48
1993.6750490	0.69
1994.6680910	2.20
1996.1121830	0.50
1998.0701900	5.23
1998.8052980	1.37
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1060.85
Annotation	Unknow
Peak:m/z	Relative Intensity
302.0032349	0.18
319.2165222	1.10
376.2200317	0.14
394.2380981	100.00
556.1818848	0.78
673.5462646	0.10
773.3125000	0.76
897.7253418	1.09
898.5068359	0.45
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	353.1
Annotation	Salviandulin E
Peak:m/z	Relative Intensity
85.8107147	0.20
112.1441574	0.16
121.9536285	0.16
129.6912994	0.15
151.2841492	0.34
160.0744019	2.08
170.3967896	0.49
174.9201965	0.56
177.9099426	3.12
180.2719116	0.30
182.1380157	0.32
185.1977386	0.22
187.1267700	0.28
191.2118683	0.40
197.1470032	0.33
198.1918030	0.12
202.3684387	0.08
203.1800537	0.43
205.1452332	1.08
211.0048218	0.15
218.2156677	0.29
219.0783081	0.24
220.2304077	0.07
223.1254578	1.08
224.1114197	0.65
228.0419922	0.17
233.0270081	0.18
234.1613159	0.16
242.0960388	0.08
243.1620178	0.15
251.0790710	100.00
255.2396240	0.07
264.1848145	0.31
271.1450806	0.27
275.3617554	0.09
279.0840454	0.20
282.1943054	0.17
289.2035217	0.12
292.4985657	0.09
295.0426636	0.46
295.7618408	0.07
302.0387573	0.10
307.1416016	11.53
308.3194885	0.85
314.8551941	0.63
317.1791382	0.57
322.6923828	0.13
325.3138733	0.11
329.2689209	0.35
332.3045654	0.26
335.1813049	15.88
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	463.0879
Annotation	6-Hydroxytricetin 5-rhamnoside
Peak:m/z	Relative Intensity
133.1690216	0.03
145.1204224	0.01
151.0779572	0.74
152.1130371	0.08
152.9996185	0.00
161.0298462	0.03
162.1997681	0.01
163.1728058	0.04
169.0547333	0.02
173.1819458	0.01
175.0775146	0.01
176.9939575	0.01
178.9632874	1.24
180.1116943	0.12
183.8828125	0.01
189.1691589	0.03
190.1820374	0.08
191.0725403	0.03
192.5169373	0.03
193.2824707	0.03
197.2358093	0.01
198.1820679	0.01
203.0983582	0.02
204.2390747	0.01
207.1049652	0.07
209.2031097	0.05
211.0600586	0.04
212.2013092	0.02
213.2620239	0.05
214.2057800	0.03
217.1802521	0.12
221.2438354	0.07
226.1285553	0.01
227.2360229	0.03
229.2399750	0.12
231.1115570	0.00
233.2620850	0.10
234.3173218	0.01
236.9819336	0.01
239.3178864	0.02
240.0609436	0.04
242.0306549	0.01
243.1627197	0.01
247.0542908	0.05
250.1716614	0.01
251.3402710	0.02
252.0483398	0.01
254.3728638	0.04
255.2205200	0.17
256.2020264	0.07
257.1845398	0.12
258.1163330	0.01
259.2344666	0.00
262.3908386	0.01
265.9597473	0.00
269.1547241	0.01
271.1514893	0.26
272.3826599	0.07
273.1692505	0.22
274.2742920	0.05
275.2973938	0.01
276.9194946	0.01
281.2028809	0.03
283.1384583	0.08
285.3215027	0.02
286.2803345	0.02
287.1327515	0.00
296.4819946	0.03
297.6249390	0.04
300.1522217	17.70
301.1505737	100.00
302.1193542	18.22
302.7803040	0.02
305.3073730	0.02
311.2259521	0.01
312.2261963	0.04
313.1049805	0.18
314.1869812	0.03
315.1910400	0.05
319.1434631	0.05
325.1998901	0.07
326.1061401	0.07
327.1183472	0.07
329.2451172	0.00
331.3333130	0.03
335.2020874	0.02
337.2001343	0.10
338.3519897	0.01
341.1860352	0.02
343.1705933	1.68
344.2940979	0.42
353.1593628	0.09
354.1384583	0.04
355.0048218	0.03
356.3614807	0.03
359.0196533	0.04
367.3137207	0.01
373.1628113	0.17
374.2319641	0.03
375.1996765	0.03
376.2113647	0.01
382.9489441	0.00
385.3300476	0.03
395.2591248	0.01
397.1337585	0.01
402.3298645	0.00
403.2060242	0.01
409.5527039	0.01
417.3927917	0.01
418.1567688	0.02
419.2512512	0.07
420.5175171	0.02
421.4747620	0.02
426.0582581	0.01
427.2949524	0.02
428.3000793	0.03
434.3762512	0.01
436.2843933	0.02
444.6694641	0.09
445.4608459	0.16
446.4503174	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	304.0554
Annotation	Cyanofenphos
Peak:m/z	Relative Intensity
94.9047623	0.24
96.9896774	0.16
113.0230408	0.30
114.9966888	0.12
115.9420776	0.66
116.9164200	1.54
118.9849091	0.58
121.9618149	12.52
129.7749329	0.23
137.0762329	0.10
139.1774902	0.21
140.0639648	0.88
141.0983582	0.13
142.0081482	0.13
143.1722717	0.10
144.9733276	9.63
147.0242004	0.45
149.1971588	0.07
151.1302490	0.07
152.7909546	0.21
154.0008850	0.13
155.0080261	0.18
156.2584991	0.36
162.0043640	35.78
162.8528137	0.11
164.7998962	0.50
166.3379211	0.13
168.2191162	0.39
169.0188599	0.46
170.1316833	0.14
175.0031281	0.15
177.0287170	1.06
178.9496460	7.27
182.2167969	0.28
185.2092896	0.39
194.0725555	0.33
198.8852234	0.26
202.2494202	0.71
203.9507141	0.17
205.4739075	0.16
208.1366272	0.23
208.8911133	0.07
214.0634155	0.64
219.1828003	0.13
221.1275024	0.13
222.2131958	0.11
223.1722107	0.26
226.0433044	0.96
228.1706543	0.44
231.0461731	0.09
231.9816895	0.70
232.9350281	0.67
234.2563477	0.32
237.2745667	0.77
239.8143616	0.16
241.2095947	1.06
242.2037964	0.16
243.3850098	2.97
244.1192627	0.16
245.3247070	0.31
246.2691956	0.41
249.1594849	0.14
250.1130981	0.06
251.0962830	0.44
254.0150452	0.11
255.1739502	0.57
257.1196594	0.79
258.0858765	0.40
258.8639832	0.50
260.0924988	0.79
261.1773682	0.17
262.9355164	2.66
267.1943054	0.54
268.8931885	0.54
273.0016479	0.29
274.5374451	0.43
275.2840881	0.27
275.9225769	0.31
280.2473450	0.35
280.9098206	1.21
285.2139587	3.89
286.0610046	4.11
286.7030029	1.91
287.3328857	2.69
289.3256226	0.08
291.0484314	0.25
292.2640076	0.40
294.6687317	0.75
303.3388062	0.49
304.1669617	0.11
308.2713318	12.21
317.0367126	1.31
325.0762634	0.09
340.1133728	0.80
341.9902649	0.09
343.2565002	0.10
348.2138977	1.18
357.0986633	0.52
358.0454407	0.55
371.2600403	0.38
382.1318359	0.56
398.3800659	0.35
410.5043335	0.43
411.3377380	0.20
414.2572327	0.99
415.2780457	0.37
430.3014832	0.33
441.2460327	0.24
443.9913940	0.38
446.1368103	100.00
447.4058228	0.25
454.1458130	0.50
464.5516052	0.18
475.8734436	0.07
485.6361694	3.11
486.2506714	52.70
589.9194336	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	567.3329
Annotation	Unknow
Peak:m/z	Relative Intensity
261.1591187	0.10
347.2770386	0.05
355.3654785	0.05
356.3145142	0.04
371.3226318	0.07
392.3752441	0.07
393.3488159	0.35
421.0806885	0.14
521.2182007	100.00
536.9313354	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	457.1806
Annotation	Unknow
Peak:m/z	Relative Intensity
166.1833191	0.38
183.9041443	0.08
199.1646271	0.12
208.0960693	0.53
238.2166290	0.73
251.2177734	0.16
256.0104370	0.53
272.4314880	0.04
274.1408386	2.74
274.9823608	0.08
278.2916260	0.13
292.3450317	0.70
295.2876892	0.63
308.8059082	0.06
328.2334595	0.13
333.3017578	0.09
336.3403320	0.14
340.8513184	0.07
348.0688477	0.07
361.3375244	0.11
373.2308044	19.06
385.1773987	0.20
403.3009644	2.84
411.3856201	0.31
421.2841492	37.35
428.9761047	0.06
439.2246399	100.00
440.0967102	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1092.44
Annotation	Unknow
Peak:m/z	Relative Intensity
334.9305115	0.29
422.9984436	0.33
440.2639771	0.21
560.4024658	0.58
621.4445801	0.50
630.6213379	0.21
824.0052490	0.47
915.6690674	3.01
1022.3862300	1.29
1032.2287600	1.25
1043.2088620	0.44
1045.1743160	1.63
1047.1016850	2.21
1049.6252440	0.60
1051.6383060	1.31
1055.7590330	4.97
1056.5496830	1.44
1065.3485110	2.15
1068.2390140	2.18
1149.0300290	0.67
1150.9468990	0.15
1151.6358640	2.45
1165.7341310	0.54
1172.0571290	4.53
1177.9460450	1.89
1180.8150630	0.63
1182.4443360	2.41
1194.0997310	0.33
1195.3662110	2.65
1196.1096190	0.41
1204.7784420	4.07
1205.4873050	2.74
1211.2790530	3.73
1218.0714110	2.44
1223.0810550	5.52
1224.1757810	4.90
1225.3189700	1.88
1227.3995360	0.96
1231.5120850	0.47
1233.6192630	2.65
1235.8281250	3.18
1236.8167720	7.50
1238.7172850	1.32
1247.0657960	3.15
1249.7279050	1.94
1252.6235350	6.20
1255.7236330	12.68
1274.0250240	0.98
1333.2454830	2.77
1345.3997800	1.59
1389.9654540	1.61
1393.7416990	0.71
1435.1575930	2.41
1443.2724610	1.84
1472.8809810	2.88
1476.1585690	1.44
1481.9344480	1.67
1485.9268800	1.54
1514.4044190	0.92
1527.0529790	1.01
1590.1519780	1.43
1593.1844480	1.55
1603.4339600	2.53
1610.2855220	0.24
1631.9866940	1.48
1663.5716550	0.58
1691.5358890	0.63
1692.5451660	0.31
1702.6712650	0.20
1710.8411870	1.06
1713.3977050	0.61
1715.4097900	0.47
1736.6423340	0.54
1746.1278080	1.03
1749.2088620	0.34
1751.1462400	0.76
1755.9361570	0.27
1760.1540530	0.70
1767.9919430	0.27
1772.0582280	0.86
1774.6138920	0.76
1786.2146000	0.13
1793.7927250	1.99
1802.3963620	0.14
1803.1226810	0.24
1808.5842290	0.18
1814.0802000	0.25
1821.0518800	1.19
1822.0603030	0.37
1823.6156010	0.37
1825.2077640	0.37
1828.8068850	0.34
1839.6287840	0.26
1841.9025880	0.33
1852.8551030	0.14
1855.6262210	3.35
1857.0202640	0.47
1860.1514890	0.39
1861.5272220	0.31
1863.8978270	0.14
1864.5255130	0.10
1875.6789550	4.60
1878.1510010	5.75
1879.3367920	28.13
1881.0296630	0.18
1882.7049560	1.57
1883.8619380	0.39
1886.0998540	2.51
1888.1247560	0.65
1894.6081540	0.56
1897.4383540	0.21
1899.5010990	0.24
1900.6485600	0.42
1902.0936280	1.74
1902.7694090	0.57
1905.7139890	0.24
1906.8488770	0.41
1907.6617430	5.90
1909.3885500	0.28
1913.6134030	0.48
1914.2979740	1.05
1916.3245850	4.53
1919.1418460	7.51
1920.5446780	3.91
1921.2399900	0.36
1923.0266110	0.85
1923.9124760	0.70
1925.6871340	0.29
1927.2194820	0.66
1929.9001460	7.06
1933.2493900	0.80
1937.6988530	2.17
1939.2799070	0.60
1944.6131590	0.13
1946.1094970	1.37
1948.3558350	0.68
1954.2398680	1.39
1956.7691650	4.36
1958.4216310	0.20
1960.8306880	18.92
1963.5168460	1.83
1965.0489500	0.87
1966.1384280	1.87
1967.0635990	0.62
1968.5812990	0.73
1969.5614010	10.90
1970.2459720	0.75
1971.1008300	1.77
1972.8851320	0.63
1975.2828370	2.52
1976.4664310	23.28
1977.4412840	0.33
1978.7222900	2.85
1980.5389400	0.40
1981.2550050	3.19
1982.6911620	1.35
1983.2930910	1.15
1984.3806150	0.91
1984.9879150	8.76
1986.2926030	4.65
1988.2380370	16.78
1989.0700680	0.20
1990.4505620	0.73
1991.4766850	0.47
1992.6290280	2.29
1993.4432370	0.72
1994.9006350	100.00
1995.9250490	2.94
1997.2521970	14.99
1998.1252440	0.37
1999.4948730	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	344.31
Annotation	Dihydroceramide C2
Peak:m/z	Relative Intensity
109.2984238	0.35
119.5395508	0.39
123.0283432	0.34
144.4807434	0.23
149.0543518	0.71
150.2611694	0.25
151.1391296	0.22
164.1193542	0.16
169.1038666	0.22
175.342804	0.37
176.197113	0.84
177.2580872	0.37
187.2410278	0.43
188.4097137	0.18
191.1177673	1.16
203.1075439	1.13
205.9929962	1.14
209.1270447	0.13
211.3452148	0.13
212.1028748	0.18
214.9769287	0.68
228.668396	1.10
231.4390259	0.13
233.4688721	0.31
239.1091919	0.78
240.0715942	0.46
242.3855591	1.49
243.9708252	0.36
248.1758728	0.38
249.3156128	0.78
250.1486511	0.22
254.1602173	0.22
254.9597473	0.16
260.0856018	0.68
267.2707214	0.41
268.4080811	0.14
269.980896	0.21
273.4046631	0.62
277.4396973	0.17
278.2044067	0.16
290.3164673	0.79
291.2160034	0.99
294.8905334	2.12
295.4985962	0.63
296.3823853	1.77
299.8136292	0.33
300.6119995	0.16
302.6074524	1.35
308.3563843	26.54
309.3782654	0.92
313.3616943	0.35
326.3069763	100.00
327.2044983	10.78
334.8761292	2.01
354.8042297	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	387.186
Annotation	L-Arginine
Peak:m/z	Relative Intensity
195.1961517	1.70
196.0127563	8.66
213.1283264	100.00
299.2562866	0.03
302.2021484	0.02
302.9128723	0.04
327.2722473	0.07
342.2549438	0.20
369.6190186	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	464.96
Annotation	Fluazinam
Peak:m/z	Relative Intensity
191.0864563	0.46
251.0236816	47.64
252.0922546	35.75
253.0016785	100.00
380.9312744	21.47
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	275.0924
Annotation	Minumicrolin
Peak:m/z	Relative Intensity
79.2036209	0.02
82.8499832	0.03
107.0392914	0.49
112.9470444	0.03
119.1367340	0.01
120.8285370	0.05
125.1010895	0.85
126.8919449	0.03
139.0181274	0.06
142.9461060	0.02
144.4506531	0.04
151.0498047	22.65
164.3122101	0.02
169.0051270	10.95
169.6774902	0.01
171.0610046	0.07
175.0921783	0.08
177.1441193	0.05
179.1967468	0.04
182.9619293	0.03
185.1702271	0.08
185.8960266	0.06
186.8701172	0.04
189.4856720	0.05
191.0052490	0.03
195.1970215	0.02
196.0701294	0.08
196.8858948	0.02
201.1599121	0.02
203.0355530	0.01
213.1391602	7.47
218.9693298	0.04
229.0255432	0.28
231.0715332	0.52
232.1690369	0.03
233.1558533	0.02
239.2848816	0.15
245.0728149	0.12
245.7136230	0.06
247.3263855	0.02
257.1159363	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	259.1298
Annotation	Gamma-Glu-Leu
Peak:m/z	Relative Intensity
109.55159	0.06
112.970047	0.05
128.033905	100.00
130.0813904	2.41
141.1462097	0.02
184.9957733	0.04
202.1386871	0.09
213.1036987	0.29
215.1890106	0.12
216.3681488	0.10
223.2062683	7.43
228.9943085	0.18
241.1279297	41.89
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	523.34
Annotation	Unknow
Peak:m/z	Relative Intensity
158.2371216	0.27
175.1415710	1.20
195.8835144	0.18
213.0605164	2.43
332.0512695	0.07
349.0514526	100.00
368.3037720	0.67
386.8710938	4.20
388.4206543	0.34
506.0958862	0.80
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	863.2437
Annotation	Lantanose A
Peak:m/z	Relative Intensity
341.0349121	0.06
383.0674438	0.16
392.1279907	0.06
394.5045776	0.03
442.8570557	0.05
485.2150269	0.07
502.2993774	0.05
503.2391968	0.13
539.3062134	0.21
545.1895752	0.10
557.4238281	0.03
647.3976440	0.22
683.3339844	0.06
701.5728149	0.07
827.4030151	100.00
828.0147095	0.69
844.5151367	0.12
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
122.9995117	0.05
135.9637756	21.68
147.0773163	0.18
164.9671936	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	379.08
Annotation	Lisetinone
Peak:m/z	Relative Intensity
113.7906723	0.07
114.8234787	0.05
130.8404846	0.12
143.1186523	0.27
144.0409546	0.04
145.0453796	0.05
160.9875488	0.41
162.1107178	0.14
179.0320129	3.36
180.1635284	0.49
181.1906128	0.19
198.2314148	0.08
199.0920410	0.48
215.0890808	2.06
216.1098328	2.50
217.0946960	8.95
250.3096924	0.05
251.2080994	0.30
251.9821167	0.03
264.0401611	0.10
289.0660706	0.04
293.1713257	0.04
341.2032166	100.00
342.2050781	37.86
343.2769165	8.34
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	520.1683
Annotation	Unknow
Peak:m/z	Relative Intensity
142.9520721	2.05
178.0895538	100.00
270.5130005	5.04
296.3397827	10.05
297.4925537	0.80
324.9329224	2.15
339.1843262	6.84
339.8952026	22.51
357.6029663	11.78
462.5382690	3.50
502.2542114	9.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	665.2151
Annotation	Lychnose
Peak:m/z	Relative Intensity
195.1900940	0.05
196.9981995	0.11
203.2211151	0.66
215.2487183	0.13
218.8383636	0.03
233.0759888	1.86
235.1915283	0.57
250.7036743	0.68
251.3449707	0.03
254.2374573	0.10
257.1498718	0.29
261.3715820	0.13
275.1987000	0.58
293.0947571	0.11
311.2721863	0.08
323.2437134	24.15
329.0242920	0.21
341.2923584	10.72
347.2476807	0.12
381.2473755	0.22
383.2797241	5.82
395.2507324	8.13
397.0665283	0.10
407.3502197	0.08
413.3449097	0.28
415.0958862	0.05
443.1758423	0.17
467.0720215	0.60
485.2377930	100.00
485.8446045	0.33
490.1061401	0.11
491.2778320	0.09
503.3300781	4.48
504.3673096	0.15
539.5313110	0.07
575.2940063	0.27
576.9511108	0.09
631.6931152	0.05
633.6851196	0.29
647.2488403	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.109
Annotation	D-Galactofuranose
Peak:m/z	Relative Intensity
96.8223114	0.33
98.8980713	0.29
100.9801865	5.73
105.0432510	0.11
106.6929321	0.29
113.0213776	18.43
115.1338196	0.12
116.8670349	0.28
118.9821472	11.55
125.0053101	2.55
130.8998413	6.12
142.9634705	20.38
149.0404358	3.09
160.9701080	22.50
169.7682495	0.14
178.9658661	100.00
182.9755859	0.16
183.9366913	0.40
184.9208069	0.18
197.1452942	0.12
198.8749847	0.31
250.7345581	0.40
281.0317383	1.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	565.0472
Annotation	UDP-D-galactose(2-)
Peak:m/z	Relative Intensity
162.7625885	0.03
193.1653748	0.06
211.0964355	2.66
216.9240723	0.05
223.0990295	0.01
241.0538025	0.87
259.1944580	0.04
262.1026611	0.06
273.0885010	0.03
280.1785889	1.23
305.0870972	0.14
321.1761475	0.86
323.1031494	100.00
324.2785645	0.14
339.1528931	0.02
352.2603149	0.02
385.1652222	1.81
390.9834595	1.08
395.0192261	0.04
396.9041138	0.06
403.1127319	2.61
428.9971924	0.26
429.7955322	0.03
453.2241211	0.02
467.1807861	0.23
475.2183228	0.06
478.5635376	0.06
479.2080078	0.09
480.7168579	1.09
481.4833374	0.03
485.1166382	0.03
517.2047729	0.02
518.1661987	0.17
518.8794556	0.31
522.2108154	0.05
547.2515259	0.69
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	470.1599
Annotation	Unknow
Peak:m/z	Relative Intensity
135.9653931	0.06
142.9425354	1.95
149.0247498	0.11
152.1276245	0.04
160.1000061	0.37
162.1314087	0.04
171.2046204	0.13
177.1778259	0.11
187.1313629	0.03
188.1573486	0.13
193.1265869	0.89
206.0796204	0.34
212.9897614	0.05
219.1231384	0.08
221.0465851	0.05
224.1806946	0.83
231.3426208	0.21
237.0338593	0.76
242.3860168	0.27
244.1781311	0.20
259.0476685	0.05
260.3489685	0.28
263.1705017	4.85
270.1661682	0.29
272.2595520	0.03
275.1566467	1.72
288.2765198	1.95
289.2303467	0.16
291.0785828	0.03
306.2546387	1.62
309.3587036	0.12
310.9515076	0.05
314.2321167	0.82
320.2265625	0.21
332.2272949	100.00
332.8420715	0.13
340.4317017	0.57
350.2875366	77.90
357.1356201	0.07
366.2153931	2.13
372.3172913	0.06
384.2653503	34.40
394.8024597	0.16
402.1203308	0.07
423.4808044	0.07
425.7582397	0.18
426.3923950	0.67
432.3509216	0.04
433.9696045	0.38
435.2383118	0.12
452.2807007	8.47
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	306.0766
Annotation	Stealthin C
Peak:m/z	Relative Intensity
99.1082993	0.28
119.9721527	0.38
128.0139008	9.02
129.0912323	0.26
130.0924988	0.05
143.0703888	9.37
144.0622559	0.13
145.2164612	0.22
146.1646729	1.37
150.0890350	0.09
152.9016113	0.21
154.1651306	0.25
159.0172424	0.21
159.9898529	10.60
167.2429199	0.46
169.1927490	0.23
170.0516968	0.15
171.0067444	2.54
172.1726227	0.17
175.8294373	0.08
177.1157684	8.65
179.0732117	9.06
182.9829102	0.15
185.0801392	0.75
192.0670013	0.04
193.2578430	0.17
197.1656036	0.70
203.3628235	0.20
210.1948853	4.76
212.9722595	1.84
215.1754150	1.15
216.2382507	0.42
217.5146790	0.09
227.1005554	0.10
228.1968994	1.16
229.2412415	0.22
230.9704895	1.46
235.0219116	0.08
236.1620483	0.20
237.2605896	0.11
240.5816650	0.12
242.1610718	1.20
244.2771606	0.14
254.1016846	83.38
260.0457458	0.19
261.3413391	0.07
264.1483765	0.48
265.1036987	0.24
270.2234497	0.15
272.1463623	100.00
277.0861816	0.12
288.1202393	61.54
288.7670288	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	325.1122
Annotation	D-Fructofuranose 1,2':2,3'-dianhydride
Peak:m/z	Relative Intensity
96.9828720	0.14
98.8255005	0.20
102.8556290	0.06
107.0033569	0.11
109.0396957	0.44
126.9858398	4.14
132.0292206	0.25
139.1317749	0.13
144.9913177	3.20
162.9451752	5.83
175.0700378	0.99
177.0535736	0.31
180.2135315	0.29
192.8949738	0.69
194.1522217	0.08
195.2065735	0.50
199.2116547	0.21
205.3326111	0.15
207.2605896	0.10
210.5193787	0.10
211.2375488	0.68
212.2344666	3.01
213.1307678	0.39
217.0255127	0.99
222.9191284	0.95
228.9097290	0.43
239.2633972	0.17
240.6543884	0.51
241.2786865	0.59
243.2554932	0.17
246.9328003	2.39
250.9290161	0.07
252.9258423	6.38
254.9492188	0.18
256.9176025	0.53
257.9695435	0.69
258.9077148	7.79
262.9866333	0.28
264.4767151	0.11
265.5639648	0.17
268.2136841	100.00
269.2476501	16.79
270.2969666	0.68
271.0950317	8.23
278.9042969	0.33
280.4669800	0.11
282.2422485	0.21
283.3509216	0.21
287.4653320	0.24
288.4089966	9.65
289.0366516	35.64
293.2919617	0.06
296.3641968	0.66
297.3479614	0.17
307.0418701	3.96
307.6953125	0.17
315.3826294	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	701.1917
Annotation	Lychnose
Peak:m/z	Relative Intensity
214.8784485	0.02
250.9744263	0.04
323.1124268	0.06
341.1874084	0.43
377.1257935	0.03
383.4216919	0.47
392.3825073	0.09
395.4315186	0.19
439.2114868	0.01
443.1456909	0.15
485.3190918	1.06
503.2760620	0.19
504.2218628	0.05
508.2338257	0.03
521.3870850	0.09
539.2874146	0.71
543.0869751	0.02
545.3898926	0.13
568.7342529	0.03
665.3604126	100.00
666.0177612	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	518.1549
Annotation	Unknow
Peak:m/z	Relative Intensity
161.1580200	0.13
176.0009155	55.89
178.9274902	2.77
221.2391510	0.15
311.2069702	0.15
341.2536011	100.00
500.2637329	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	380.84
Annotation	Unknow
Peak:m/z	Relative Intensity
128.9888916	5.01
154.1705475	0.11
212.8484802	5.59
245.0051880	0.22
260.7649231	0.17
265.0244141	0.12
296.7396851	100.00
297.4352112	0.78
335.0272522	0.49
350.9769287	0.12
363.1969910	0.12
364.4756775	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	392.1133
Annotation	(gamma-Glutamyl-gamma-glutamyl)-S-methylcysteine
Peak:m/z	Relative Intensity
128.0110474	3.43
135.1169891	0.13
140.9565125	0.02
143.0501709	5.52
145.1906586	0.29
146.0134125	0.36
153.0780640	0.19
159.8934937	0.17
166.2461548	0.37
166.9698181	0.18
169.9111633	0.11
171.1285095	0.19
177.0334015	0.44
179.0254517	7.89
183.1961060	0.09
185.2071838	0.20
192.1786194	0.26
193.0650940	0.12
196.9083710	0.50
210.1658020	4.90
228.2220154	0.30
236.0291443	0.29
242.2244873	0.07
246.1123962	0.02
254.1348877	75.33
263.1099243	6.61
263.7516785	0.13
272.1619263	100.00
288.1793213	4.23
299.2318726	0.10
306.2369385	46.78
356.3167419	0.15
374.2782593	19.05
375.0375366	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	387.19
Annotation	Unknow
Peak:m/z	Relative Intensity
195.2910309	2.38
196.0522461	7.19
213.0531006	100.00
232.0655823	0.81
240.2384033	0.07
267.4137573	0.15
297.0985107	0.05
327.4072266	0.19
341.1271057	0.05
358.8541870	0.12
368.3140869	0.07
369.1766663	0.29
370.1319580	0.18
378.5508118	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	445.0576
Annotation	Unknow
Peak:m/z	Relative Intensity
133.8759460	0.05
176.9609070	0.18
191.5549316	0.09
211.1717529	0.25
217.1483307	0.10
222.7752380	0.04
229.5161743	0.10
238.2678833	0.15
240.4642944	0.06
242.9618530	0.08
252.9124146	0.06
273.4114075	0.12
291.4717407	0.06
298.6143188	0.07
307.0363464	0.25
309.1899109	0.11
315.9754333	0.11
317.2524414	0.06
328.2995911	0.03
330.3966675	0.20
356.0893555	100.00
356.6978149	0.69
371.6810608	0.06
381.6465149	0.15
384.4879456	0.14
388.3017883	0.46
398.0097046	0.13
398.9562683	0.39
401.0020447	0.11
411.8047485	0.41
412.6828308	0.06
414.8488770	0.06
416.6478882	0.07
426.3876953	0.34
427.2492371	0.74
428.2901917	0.55
429.4242249	0.17
430.3432922	0.05
436.6712341	1.21
448.2475281	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	482.7888
Annotation	Unknow
Peak:m/z	Relative Intensity
146.9268646	0.66
189.0234375	0.09
191.0194702	3.74
248.7269897	0.11
262.7823486	0.10
266.8780518	0.06
290.8591614	0.22
292.9039612	4.38
335.1702576	1.67
336.8578796	100.00
338.0184326	0.22
338.9758911	0.69
346.8273926	0.05
349.0356140	0.21
362.8601074	0.09
365.0410461	0.39
380.0506287	0.17
392.9503479	0.53
395.0217896	0.56
408.9158936	1.53
411.0942078	0.27
437.0063782	1.77
438.8836060	5.27
440.1674194	0.10
444.3063965	0.10
451.7991638	0.25
455.1173401	0.43
464.9895325	0.47
482.5406189	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	274.9545
Annotation	Unknow
Peak:m/z	Relative Intensity
79.8758011	1.18
80.9210510	2.37
95.0381165	0.23
112.9094467	100.00
127.1234436	0.05
129.0779572	0.28
131.1495972	0.06
140.0398560	0.07
143.9185486	14.04
144.9132843	49.50
147.1862488	0.09
153.1343384	0.28
157.1683960	0.09
161.0934448	0.11
166.2628326	0.06
175.0639648	0.11
176.6551819	0.22
185.0438080	0.20
187.3782043	0.11
191.1274261	0.10
195.1044922	0.05
202.4946899	0.23
203.1267700	0.12
211.0744019	0.41
213.1536560	0.18
228.9826965	0.16
231.1207581	0.42
239.1851196	0.54
240.9403687	0.12
249.0381165	0.14
257.1489258	2.59
258.1486206	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	589.2482
Annotation	L-gamma-Glutamyl-beta-phenyl-beta-L-alanine
Peak:m/z	Relative Intensity
166.0813904	1.86
168.2252197	0.09
186.1859436	0.33
216.3191681	0.10
228.9015656	0.03
230.4042969	0.04
232.1464386	0.80
277.2000732	0.30
278.2626953	1.78
281.3751831	0.04
287.2185669	0.06
295.1604004	100.00
295.7738647	0.26
297.3182373	0.13
328.2514038	0.05
353.7843018	0.10
356.2632446	0.07
373.3353882	0.08
395.4469604	0.04
421.4763794	0.02
423.8145142	0.07
431.0810547	0.08
438.0917358	0.07
441.0747070	0.17
442.0491333	0.11
458.1582642	0.18
459.1059570	0.15
460.1715698	0.32
476.1661987	0.14
513.4149170	0.05
538.4178467	0.03
542.2073364	0.03
570.2686768	0.25
571.0515747	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	705.1821
Annotation	Lychnose
Peak:m/z	Relative Intensity
337.4470215	0.15
363.1899414	5.18
381.2766724	7.95
469.3071899	0.08
484.9733887	0.12
525.3037720	18.48
543.2826538	100.00
543.9397583	0.34
615.2363892	0.44
645.4075317	0.31
687.5454712	0.38
691.0444946	0.08
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
68.9828644	0.36
71.8853989	2.24
86.0312958	0.08
86.9726257	0.21
88.8349915	0.08
89.9533615	29.02
97.6791840	0.38
98.3785400	0.10
115.9627686	4.74
124.0585327	0.37
131.0535889	0.37
142.2277985	0.04
154.5923309	0.30
156.1039734	0.22
160.2060699	0.23
160.9149323	0.10
166.1411591	0.99
171.9667206	0.34
174.0780182	4.68
179.0601044	0.15
184.0288086	27.32
186.1525726	0.11
187.6393433	0.23
189.3677826	0.14
192.1142731	0.10
195.5888519	0.08
200.3493652	0.05
202.0582123	100.00
204.0567780	0.06
210.6307831	1.14
220.7757568	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	332.0467
Annotation	Unknow
Peak:m/z	Relative Intensity
96.8988495	0.36
120.9222488	0.09
126.2267456	0.11
138.2556152	0.25
141.0555267	0.20
147.0059967	0.25
162.0740967	1.93
164.9139709	0.31
180.9868469	0.16
194.2595825	0.26
197.0555420	0.25
198.1829529	0.28
202.1786041	0.09
203.4309235	0.49
205.0757599	0.34
211.2847290	0.11
217.2439575	0.41
219.2305908	0.50
227.2029114	0.40
232.8009644	0.16
237.3425293	0.23
243.2780457	0.77
255.0483093	0.62
256.1081848	0.12
260.0050659	19.87
272.0252380	0.41
281.3258667	0.27
282.3937988	0.27
284.3784485	0.16
288.8853455	0.12
290.5979614	0.14
297.3235168	0.23
300.0138855	100.00
301.0519409	0.21
313.3537292	0.77
315.0299377	5.48
344.4918518	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	344.0917
Annotation	Unknow
Peak:m/z	Relative Intensity
98.9653778	0.23
115.9546814	0.68
129.9416199	35.76
131.0765839	3.37
144.1503906	0.17
162.0055237	6.07
163.0704041	1.03
169.8395691	0.18
170.9275513	0.46
172.9983978	0.36
177.0953064	0.99
178.8943634	3.53
179.9853516	0.56
201.1469727	0.66
202.1172180	3.28
203.1430054	0.26
211.0110168	14.43
211.7734680	1.77
212.7951660	0.26
213.4499817	0.24
217.0769043	0.32
219.1883850	10.09
220.1069031	0.34
228.0775452	5.67
229.0692444	0.59
233.0370483	0.26
237.1520081	0.23
245.1294250	4.60
245.8403931	0.29
246.9910889	1.58
247.6493225	0.20
251.0724487	10.87
252.0196228	0.13
252.8590393	0.37
257.2712402	1.11
265.2045593	2.08
271.0553589	2.85
272.1499023	0.55
273.1084595	0.43
275.0727539	0.56
277.0574646	2.23
278.1726379	0.34
279.7152100	100.00
280.6109314	10.75
281.3522034	1.68
284.9945374	0.63
286.8491211	0.25
288.1761780	0.70
292.4175415	0.99
297.7622681	1.25
298.6869202	1.91
300.1718750	0.56
305.3916626	0.37
306.7584839	48.95
307.9550781	17.20
309.2009583	3.04
310.2962952	1.02
312.2597656	0.76
313.6691895	0.26
322.2127075	0.60
327.1775818	3.33
330.3643799	0.56
335.5887451	34.07
336.3316345	10.46
336.9469604	1.06
339.8102722	0.26
344.5416565	1.03
348.2716980	0.83
348.9804993	0.13
361.9670105	0.50
380.1763916	23.50
381.1718445	3.40
382.2088928	1.09
384.0983887	0.48
403.3438416	0.32
429.1137390	36.86
430.1822205	9.06
431.2917175	8.59
438.2253723	14.03
439.2825623	2.09
440.2782288	0.53
449.3220520	0.70
452.8096008	0.42
455.3884888	0.60
465.3475952	0.28
482.9639587	0.79
483.7335815	5.73
484.5706482	0.13
540.3772583	2.54
541.5464478	2.88
542.4036865	1.20
558.2064209	53.53
559.1956177	12.09
560.2746582	4.62
612.3414917	3.08
613.5271606	0.70
652.6656494	0.39
658.0757446	1.63
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	551.2364
Annotation	Unknow
Peak:m/z	Relative Intensity
161.9955139	1.58
169.8850708	1.50
188.1890564	1.06
197.9660645	1.18
205.4507141	0.23
218.1872864	0.76
227.6448212	0.31
244.3544006	4.85
255.0662537	0.40
258.1122742	0.20
261.2197876	77.01
273.0707397	1.37
273.9645386	0.68
278.6786804	0.26
291.1804504	100.00
293.2414551	0.48
303.2244873	0.34
306.2617798	0.41
329.1893921	1.06
345.0391235	1.50
346.1080933	2.79
347.1994019	4.25
364.0636597	0.47
373.8851929	0.19
375.3272095	0.81
404.0414429	0.35
407.4216309	0.37
420.1347656	1.83
421.2926025	2.50
422.3178711	1.19
447.0878296	0.23
460.1231689	0.88
504.2289429	0.79
505.3471680	0.41
531.9376831	0.37
533.1879883	2.35
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	423.1273
Annotation	Fortuneanoside I
Peak:m/z	Relative Intensity
143.1723938	0.08
156.1914062	0.07
174.0890198	0.11
177.2150574	0.15
190.4092712	0.19
201.0725708	0.20
202.2221069	0.04
203.0133820	0.20
229.2703400	0.08
231.1120300	0.06
233.0599976	0.20
243.1733093	0.15
261.0939331	100.00
265.0916748	0.26
271.6013794	0.03
281.2317505	0.18
283.4505615	0.16
322.6541138	0.09
342.1779785	0.54
342.7858582	0.14
350.1317444	0.18
355.1953735	0.09
369.5237427	0.15
371.3285828	0.05
377.3648376	0.34
385.0811462	0.13
391.2487488	0.27
392.2634583	0.06
404.9532776	1.27
406.9858398	0.33
408.4759216	0.78
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	454.114
Annotation	Aristolactam I N-beta-glucoside
Peak:m/z	Relative Intensity
128.0042267	1.10
135.0242767	0.15
136.5968933	0.12
141.2093201	0.13
143.0559387	4.93
146.0915985	0.74
149.2712402	0.39
153.1941223	0.13
159.7904510	0.10
164.8043976	0.12
165.6167755	0.07
167.1104126	0.95
169.0730743	3.68
169.8665924	0.39
171.1179504	0.58
177.1566162	0.16
179.0650482	11.16
181.0663452	1.04
182.2871399	0.12
185.1498413	1.79
186.2738800	0.09
189.4030457	0.35
192.0771027	0.56
197.2071381	2.09
199.2004700	0.25
203.0721436	4.12
210.1835632	8.27
215.1092377	2.44
228.1971436	0.26
229.4272308	0.07
231.0077820	8.95
236.1865845	0.23
249.2549744	3.72
249.9834900	0.17
251.4397278	0.13
254.1059570	42.98
255.3664246	0.07
272.1579590	100.00
273.3085022	0.48
285.2224731	0.81
288.1986389	22.60
304.3880920	0.29
306.1377258	20.83
316.2927246	0.28
325.1534424	1.96
326.2039795	1.29
334.3192749	0.19
346.2522888	0.66
360.0788879	16.45
376.3956299	0.08
378.1644592	49.30
380.5789185	0.09
391.3639832	0.14
407.8230286	0.11
410.1408997	0.44
420.5227661	0.10
436.1567383	32.09
436.7668152	0.44
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	500.9196
Annotation	Unknow
Peak:m/z	Relative Intensity
159.0124817	3.17
159.9847717	0.63
199.1724396	0.20
216.9848328	0.17
218.2383118	0.06
229.0617981	0.74
230.1216736	0.14
271.2066345	0.12
273.0076294	58.16
274.0870667	17.02
358.4315796	0.05
385.2361145	0.36
387.0124817	100.00
388.0683289	45.41
412.1234741	0.05
427.1975403	0.07
428.0165710	0.03
433.3867493	0.08
454.8619995	0.10
456.4721375	0.06
469.4950867	0.14
484.2653503	0.05
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
93.1537933	0.06
113.0301819	0.15
127.9560394	100.00
129.0341797	1.10
143.0728912	0.12
145.0923615	0.19
146.1195221	0.35
160.7065430	0.07
162.5157776	0.16
167.1142120	2.62
170.0858154	0.12
179.1324921	0.40
180.0509491	4.69
185.0441589	0.40
193.8018646	0.07
197.1756897	0.18
215.2508545	0.10
217.1998901	0.20
219.3392944	0.13
227.0414429	0.18
229.1817017	0.37
232.9989624	0.14
234.3465881	0.08
235.0075684	0.09
237.0029602	0.11
247.3186951	0.12
254.2381592	0.34
255.3221436	0.31
256.0900269	0.09
257.2230225	0.11
262.1576538	0.09
263.1046448	1.11
264.2498474	0.17
265.1633911	0.44
270.8643799	0.14
272.0959778	0.08
273.2075195	2.93
274.2318115	0.35
280.9603882	0.28
281.5768433	0.14
282.3475037	0.07
286.8354187	0.10
289.7767944	0.08
291.1647339	92.80
291.8024292	0.21
293.1527100	0.21
294.2517700	0.27
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
84.8962936	0.70
86.9531860	1.02
110.9928284	100.00
128.9855499	1.43
130.8233795	1.04
146.9519196	0.03
155.0124359	0.11
173.0099945	22.75
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	701.1917
Annotation	Lychnose
Peak:m/z	Relative Intensity
281.2448730	0.03
305.1762085	0.05
323.4633179	0.03
341.1423950	0.32
374.7160645	0.01
383.3830566	0.99
412.9404297	0.08
425.1359253	0.01
443.1544189	0.31
483.1373901	0.02
484.9996948	0.06
485.6008301	0.03
503.2979126	0.75
538.7824097	0.16
539.4130249	1.01
665.3560181	100.00
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
128.0371094	3.19
134.9892578	0.25
139.2684631	0.05
143.1041565	5.65
143.8945312	0.06
144.9425201	0.18
146.0055084	0.26
152.8966827	0.06
160.0786743	0.23
166.1610718	0.07
167.0659027	0.31
169.9949341	0.25
171.2815857	0.08
177.0510712	0.45
179.1247864	7.23
182.9377899	0.05
185.0879211	0.35
192.2559052	0.11
197.1564636	0.84
210.0824738	5.13
213.0990753	0.21
228.2022400	0.25
236.2613525	0.27
241.9331970	0.03
245.1072693	0.04
252.8611755	0.07
254.1365967	74.82
261.2799377	0.02
263.1797485	5.41
272.1476440	100.00
288.2272339	4.74
297.3172607	0.04
306.1143188	45.80
374.2451172	17.65
375.5570374	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	305.1029
Annotation	Murraculatin
Peak:m/z	Relative Intensity
101.0562820	0.03
106.1958389	0.09
107.0102158	0.25
113.2326965	0.05
114.9017334	0.51
119.8204193	0.14
125.0562210	0.45
127.0312042	0.05
127.9051361	0.10
139.1582031	0.10
143.3707581	0.05
145.0620117	0.27
146.9371948	0.05
151.0565491	4.79
152.9906616	0.04
155.0395508	0.22
158.6207275	0.03
160.0141296	0.19
169.0008545	2.60
171.2490387	0.29
175.0628967	0.03
176.1682281	0.15
177.3193817	0.03
179.1943512	0.19
184.9855042	0.05
197.0423584	0.25
201.2024841	0.11
204.6111145	0.09
208.8691711	0.35
212.9793701	0.05
215.0760193	0.39
215.9333496	0.03
216.9650879	0.08
221.1770325	0.12
228.3203125	0.06
231.1343689	0.08
233.1263733	0.16
243.1874390	5.34
244.0454407	0.13
245.1063843	0.09
251.8229370	0.42
253.2735901	0.30
259.0533447	1.38
261.0192871	1.40
263.1489563	0.34
263.9438477	0.15
268.1794434	0.10
269.2059631	0.80
271.4634094	0.11
272.3315125	0.12
274.7586670	0.09
277.0115967	0.13
285.0396423	0.14
287.1333008	100.00
287.9249268	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	479.1169
Annotation	Pedaliin
Peak:m/z	Relative Intensity
145.0563507	0.02
161.0474701	0.02
163.0126190	0.02
248.8301392	0.01
273.0123596	0.03
284.3173218	0.05
317.1664429	100.00
323.4954834	0.02
325.1998901	0.06
341.1828308	0.02
349.0321960	0.16
359.3437195	0.26
383.5976257	0.13
388.1361084	0.01
389.2247620	0.04
413.0037231	0.16
425.4635925	0.17
432.4555664	0.02
435.4807434	0.01
443.2891235	0.19
461.2020569	0.61
470.4726257	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	392.1133
Annotation	(gamma-Glutamyl-gamma-glutamyl)-S-methylcysteine
Peak:m/z	Relative Intensity
125.9744873	0.09
128.0042267	3.67
135.0863953	0.13
143.0767212	4.25
143.9873810	0.09
145.1281433	0.15
146.0886078	0.57
152.9949646	0.04
159.9420776	0.07
166.1549377	0.37
167.0724335	0.49
170.1192322	0.04
171.0420532	0.19
177.0926514	0.09
179.1163788	8.71
185.0297546	0.25
191.7696838	0.05
197.1004333	0.62
206.1518250	0.13
210.1121216	5.34
228.0950012	0.37
231.0710449	0.13
236.0291138	0.15
254.1168213	70.63
263.0860901	8.01
263.6941223	0.12
272.2340088	100.00
288.1973572	4.43
299.2578125	0.07
306.2072754	40.81
310.2357178	0.04
344.1954346	0.12
356.1961975	0.04
374.2787170	16.17
375.2642517	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	549.1674
Annotation	Unknow
Peak:m/z	Relative Intensity
199.1825256	0.02
206.1711731	0.01
207.0944977	0.14
217.1485901	0.02
251.2742157	0.04
323.0927124	0.11
326.6809692	0.03
327.2942505	0.06
340.9936523	0.11
369.0814209	0.02
383.4324341	0.02
387.0607910	0.09
396.5465698	0.02
397.4494019	0.02
399.0844116	0.01
414.3699951	0.04
443.2345581	0.01
503.3197021	100.00
504.2021484	0.02
513.2155151	0.01
530.0552368	0.02
531.1287231	0.01
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
78.7490311	0.08
127.9695587	100.00
130.0955658	2.29
151.0805817	0.10
179.3506012	0.06
196.9935608	0.14
213.1592865	0.43
215.1465607	0.78
215.8869019	0.07
220.0582428	0.06
223.1436005	4.64
231.2091522	0.10
239.0816650	0.16
241.1379547	59.43
247.2639313	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	251.06
Annotation	Silver sulfadiazine
Peak:m/z	Relative Intensity
73.1431732	0.41
75.9635849	0.21
85.1572189	0.12
87.0011597	1.30
97.2987442	0.39
99.0408173	0.40
104.8978577	6.37
113.0558319	0.37
116.0244293	2.51
117.0297852	2.59
119.7689514	0.66
121.9992828	35.66
122.7327271	0.21
125.8963776	0.38
129.8997040	1.45
130.8609314	0.58
132.9218597	0.24
136.1574402	0.84
145.0240631	9.86
148.1711578	0.86
148.9396362	0.24
152.2761078	0.45
153.9473877	8.42
162.0062103	51.89
163.0484009	0.40
163.7701721	0.40
168.1442719	0.44
170.0963898	0.64
174.8692932	3.17
175.9060364	1.65
176.9268494	2.07
179.0100250	1.09
183.3509674	0.17
188.1247711	1.29
189.3694305	0.30
190.4598083	49.44
191.5373840	0.82
192.8023224	0.34
194.0412598	25.36
195.2587433	0.78
199.0948029	0.61
200.0471954	0.79
202.0353851	0.13
204.9880219	1.33
207.0095978	0.66
207.6429749	0.44
208.9682159	0.78
210.0427704	1.24
211.0326691	3.72
215.4898529	0.50
216.2205353	0.20
219.1888885	4.39
223.1316071	2.73
228.1409912	3.16
232.9914398	6.30
234.0399628	1.96
234.9267731	0.15
236.2546539	0.24
242.5203857	1.06
245.1544037	0.15
253.0162964	0.40
265.1502380	2.03
268.9787903	0.58
274.1796265	0.15
286.9309387	0.29
305.1459045	0.23
306.1650391	1.85
308.2239380	45.43
309.2651978	0.19
340.1499939	100.00
340.9524536	0.36
348.2759094	12.58
372.4757996	0.19
380.1767273	84.92
382.1667786	3.63
400.4713745	0.97
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	485.1363
Annotation	5-phosphonooxy-L-lysine
Peak:m/z	Relative Intensity
142.9923553	1.56
145.1808167	1.80
162.1320038	0.24
176.9478302	18.21
201.8109436	3.46
208.9922485	4.80
219.0385590	14.59
231.1210022	0.66
233.0912170	0.44
251.0385132	16.14
267.7897644	0.19
269.1156006	9.77
273.0462341	3.00
274.1094055	1.47
276.9639282	0.32
288.1670227	0.34
305.1199646	0.82
306.2026367	6.86
334.9952393	0.71
348.1365967	12.95
356.1499023	100.00
356.7615051	0.88
362.0106506	1.51
369.2969055	0.38
380.1292114	65.24
410.3270874	14.66
467.3021851	6.77
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	213.02
Annotation	Unknow
Peak:m/z	Relative Intensity
98.9360199	0.87
120.8430634	0.36
150.9399414	0.60
166.3376923	18.85
166.9383240	100.00
169.0348206	1.90
169.8051300	0.77
171.2469025	5.37
171.9559479	13.49
173.0304565	0.51
183.0416412	1.84
184.3410797	0.38
184.9645844	0.68
189.5701752	1.63
192.4815521	2.65
195.0321045	4.31
195.9634857	1.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	561.2971
Annotation	Unknow
Peak:m/z	Relative Intensity
196.1056061	1.55
213.0856781	9.43
233.1551514	0.57
387.1171265	100.00
387.7614136	0.27
391.4381714	0.25
393.0181274	0.37
405.4033203	0.70
406.2049561	0.65
429.1070557	0.24
477.1887817	0.79
543.0019531	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	316.2838
Annotation	Dehydrophytosphingosine
Peak:m/z	Relative Intensity
109.0103836	0.02
120.9829254	0.22
132.8144226	0.06
135.1647644	0.16
153.1749878	0.03
163.1537018	0.03
178.0946350	0.04
198.1522064	0.06
225.0818176	0.10
226.3757324	0.14
242.5234680	0.28
245.3811340	0.29
263.2629395	13.74
267.3404541	0.05
269.4593506	0.11
280.2788391	31.88
280.9197388	0.03
298.1748657	100.00
298.9582214	0.30
315.9960632	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	328.2838
Annotation	Margaroylglycine
Peak:m/z	Relative Intensity
101.9036102	0.07
108.8793869	0.13
125.0216064	0.27
137.0370789	0.14
145.9422302	0.19
154.2465820	0.06
156.1295624	0.07
161.0339661	0.20
167.0208435	0.43
178.7807922	0.36
192.8563232	0.07
206.8685150	0.09
210.3545227	0.26
214.1069946	0.13
219.2088623	0.49
222.0928345	0.07
223.0345154	0.20
229.4151917	0.06
231.2366638	0.13
233.4264832	0.22
234.2491150	0.14
239.3718262	0.18
246.2240906	0.19
249.3836975	0.77
251.2841797	2.30
252.2081604	0.42
254.2268982	0.32
255.2901001	0.20
257.4331055	0.75
262.4370117	0.31
263.4988708	0.82
271.4348145	0.08
275.3046265	10.56
280.3254395	2.01
281.2265930	0.07
287.1542664	0.14
292.4472961	11.08
293.3552246	1.61
297.4070435	0.41
300.1314697	0.08
310.2489014	100.00
311.4833679	0.52
328.4732056	0.21
337.1773376	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	502.0791
Annotation	Unknow
Peak:m/z	Relative Intensity
243.0755615	1.20
306.1033630	0.12
341.5009155	0.35
355.0539856	1.12
372.1113892	4.22
373.0148315	1.22
378.1303711	0.10
380.2080688	0.28
409.3064880	0.12
410.3034363	0.12
412.4267578	0.30
414.3436584	0.11
420.8469849	0.18
427.1203308	0.10
428.3137207	0.08
429.3175659	0.11
439.4450073	0.15
442.0697327	0.10
456.1947632	0.14
470.4820251	0.12
484.0767517	100.00
484.6975708	0.91
485.5693665	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	215.03
Annotation	D-Hamamelose
Peak:m/z	Relative Intensity
71.0500641	0.22
86.9687424	0.17
88.9149017	1.80
99.0151825	0.03
100.9754028	0.25
106.6689453	0.20
113.0433502	1.12
118.9927673	2.36
125.0915070	0.32
130.8986969	0.63
143.0422821	2.61
149.0678101	0.34
158.9414825	0.10
160.9836884	6.73
176.7841339	0.06
179.0431061	100.00
197.0889740	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1187.3483
Annotation	Unknow
Peak:m/z	Relative Intensity
502.7612305	0.12
503.5741577	0.01
505.5819702	0.02
545.4206543	0.04
647.7039185	0.00
664.8278809	0.02
665.4298096	0.04
683.4365845	0.02
707.4654541	0.05
809.3486328	0.08
827.1253662	0.12
845.6595459	0.01
863.4661865	0.02
869.4691162	0.07
988.7203369	0.02
989.3753662	0.16
1007.9492190	0.05
1031.4863280	0.02
1043.5056150	0.01
1151.4934080	100.00
1152.4882810	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	626.69
Annotation	Unknow
Peak:m/z	Relative Intensity
207.1024475	0.09
243.0869141	0.19
265.8741150	0.51
290.8480225	0.87
374.7833862	1.56
451.1284180	0.34
458.2014771	3.23
458.8346558	11.23
491.0922241	0.35
496.4354248	0.34
521.0563354	0.26
529.0769653	0.25
542.0222778	14.92
542.6441650	100.00
543.2570190	0.52
580.4812012	0.14
603.3061523	0.51
608.5823364	0.35
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	518.1554
Annotation	Unknow
Peak:m/z	Relative Intensity
149.0833893	0.12
176.0712891	31.92
179.1301270	3.27
207.2212067	0.12
230.2685089	0.18
245.3728638	0.30
248.0371094	0.11
263.1941528	0.12
339.1376953	0.26
341.2499390	100.00
343.4102173	0.21
356.2474976	0.35
381.2780151	0.23
404.0040283	0.14
428.2562256	0.15
443.1915283	0.23
459.9353027	1.44
477.3610840	0.30
488.3871460	0.16
500.1494751	0.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	597.9949
Annotation	Unknow
Peak:m/z	Relative Intensity
176.9598999	0.12
179.4131165	1.32
204.3092804	0.67
209.0590363	0.39
216.0026703	0.13
222.7771606	0.09
231.0665588	1.06
232.9856262	0.23
240.9545746	0.36
250.1597443	0.31
263.0180664	0.51
281.9412842	0.14
283.1252441	0.85
288.2551880	0.77
289.0487671	0.12
295.1719360	0.54
306.2178955	0.55
307.3416138	0.34
309.0033569	0.21
313.1020203	0.48
314.5402832	0.20
315.1431274	2.00
323.1781616	0.38
328.9197388	0.17
337.7135620	0.19
339.0426025	4.58
345.0858154	0.37
347.0921021	11.56
359.3958740	0.34
363.0194702	0.32
366.2398682	1.34
371.3205566	1.12
378.9391479	3.25
394.8265991	0.65
397.3763428	0.27
399.3936157	0.50
402.1775513	0.22
410.5960083	0.75
411.1982422	3.89
414.6340332	0.16
421.3566284	0.53
442.7998047	0.20
444.1422119	1.99
449.3215332	0.53
450.9181519	2.84
458.0314331	0.23
463.6129150	0.29
468.9149780	100.00
469.5393677	0.74
474.2062988	0.65
476.2368164	1.75
482.9649658	0.12
505.7891846	0.36
508.1098022	0.97
523.1027222	9.38
523.9523315	0.28
525.7667847	0.11
535.0039673	1.60
536.8999023	0.21
539.9458618	0.18
548.2281494	0.16
552.5421143	0.42
562.0184326	0.70
566.2000122	0.46
568.4500732	0.65
572.2196655	0.58
580.0098877	12.79
580.8071899	0.20
585.8467407	1.23
589.1904907	0.18
597.9147339	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	347.99
Annotation	Unknow
Peak:m/z	Relative Intensity
96.6049423	0.65
126.8164520	0.97
143.1792450	0.94
144.0768127	0.48
144.9311218	1.46
146.1368866	2.09
151.9624939	0.66
155.3452454	0.96
158.9934082	0.82
159.9914398	2.13
162.0423431	5.86
169.0281982	0.73
172.0883331	1.28
178.0384827	1.14
178.9433136	2.31
181.1347809	0.96
182.7192383	1.32
189.1676025	1.16
192.0279694	11.23
193.9573059	15.79
208.9743042	2.15
218.2846985	0.58
219.2334595	1.05
223.9871826	30.37
225.1082764	2.04
226.0348816	84.14
226.9494019	3.53
232.1989746	1.06
256.1224976	9.44
257.9832153	100.00
258.9232483	0.59
259.8879395	2.95
262.9486389	0.66
268.4290771	0.47
273.5725708	17.89
274.1740112	3.07
290.0339050	16.00
291.2892151	0.99
297.3475037	1.76
299.0716553	2.41
302.1782837	3.70
306.2741394	0.36
309.5863647	1.19
311.2181396	0.47
316.1268005	5.00
319.2672119	1.19
329.8664551	6.06
331.3372498	1.58
338.9840698	0.74
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
94.85194397	0.61
96.91786957	0.42
98.93328857	0.51
101.0282364	1.22
108.9944687	2.81
111.2583542	0.28
121.1470184	0.50
124.9192276	0.91
127.1278305	1.02
134.7147827	1.77
136.1886292	0.72
137.1813507	0.71
138.9446716	0.91
141.2084961	1.63
143.0767212	1.84
146.1434631	0.39
146.9119568	1.04
149.205719	0.58
151.1895447	0.37
153.2302246	0.65
153.8611755	0.49
155.133667	0.77
159.2059631	1.01
160.9609222	0.47
162.8288422	0.64
167.0562439	0.24
169.1528778	0.82
170.9072418	1.41
173.9655151	0.28
175.05896	0.45
177.2042236	0.49
179.1941528	1.09
180.9788208	1.78
183.5274506	0.40
193.1654205	0.70
195.1738434	1.42
197.1600647	1.51
198.1412354	0.13
199.0398865	0.72
201.0049744	0.55
203.1862183	1.66
205.2082825	0.49
207.2828064	1.18
209.1664124	0.67
211.0314331	1.49
213.3304749	1.09
217.3556824	0.20
219.1628723	1.06
220.9047546	1.32
223.2635803	0.82
225.4284058	0.30
227.1107788	1.80
229.121582	0.52
233.1247253	1.21
235.227356	0.98
236.1514893	0.36
237.1279297	2.02
239.1878357	3.87
240.2187195	0.24
241.1055298	0.68
245.2168884	0.44
247.1796265	2.28
249.2226562	1.43
251.4490051	0.78
253.2904053	8.58
257.293335	0.53
265.3031616	6.27
267.1952515	2.70
269.3361816	2.68
270.2192078	2.10
271.0299683	0.33
273.6508179	0.39
275.2579956	16.92
283.2626648	6.20
288.4761658	1.16
293.2155457	100.00
294.2304077	0.29
301.8355713	4.46
302.6365967	1.01
310.7521057	0.46
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	546.09
Annotation	(+)-Dragmacidin F
Peak:m/z	Relative Intensity
234.0439148	8.72
239.8695679	0.52
264.0465088	5.97
276.2875366	3.84
294.1381836	1.73
304.0790100	7.86
306.0740967	8.08
324.1555786	37.45
363.2874756	0.93
364.1978149	3.61
365.2100220	14.43
365.8993530	8.73
374.4724731	2.59
380.3565674	1.25
381.6039429	2.87
382.2772217	9.84
383.1283569	22.47
383.9157715	100.00
384.7615356	0.36
395.1232910	28.49
396.0921021	46.79
411.4558716	0.84
413.9226074	1.08
427.2559814	0.94
432.8142090	0.47
455.7012329	2.05
465.9069824	3.42
486.2544556	3.28
510.0863037	1.46
515.8880005	0.47
527.0379639	27.65
528.0143433	48.87
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	310.2733
Annotation	Margaroylglycine
Peak:m/z	Relative Intensity
93.0571213	0.19
94.9285278	0.90
97.0527878	0.47
105.0400085	0.48
108.7653427	0.62
110.9532776	0.85
113.2293167	0.22
120.8857574	1.08
122.7794952	0.64
133.0239868	0.47
135.1390228	1.36
136.9170227	0.64
138.2687988	0.10
138.9316711	0.40
140.9025269	0.68
141.7947388	0.31
149.1793518	0.88
151.2200623	1.74
152.0953979	0.56
153.3248291	0.45
154.0155029	0.29
155.9660645	1.08
158.9721985	0.66
161.3000488	0.41
163.0900421	0.31
165.2591705	0.13
166.0323029	1.46
168.0057373	0.34
169.9182587	0.42
172.4070587	0.72
177.2260437	0.11
179.1867371	0.77
180.2156677	0.54
180.9533691	0.10
184.1816101	0.20
188.9332733	0.41
191.2164459	0.15
192.3766022	0.12
194.0049896	0.30
198.3128052	0.54
201.1146393	0.11
208.3161316	0.52
210.2035522	0.23
219.4436951	0.71
221.0074768	0.12
229.3169250	0.62
231.1581116	0.28
233.0566101	1.07
234.4889526	0.16
237.3099060	1.78
239.2984619	1.74
245.3146057	1.61
247.2904663	2.22
248.6565552	0.66
249.3764343	4.55
250.6841431	4.01
251.3442078	5.80
254.3098755	1.02
257.2636414	3.97
259.2017517	0.35
262.4450378	1.76
263.3242188	11.78
264.1984863	1.70
267.3191528	0.28
269.2459412	0.42
275.1846313	21.00
275.7933350	0.46
278.2958069	0.53
280.4093018	51.30
281.3221436	0.10
290.6419678	0.68
292.3121338	100.00
293.3061523	15.73
301.7217102	0.44
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	367.15
Annotation	Tetrahydropentoxyline
Peak:m/z	Relative Intensity
188.2702637	0.10
229.2032166	9.75
245.1967163	0.06
247.2460022	0.50
253.1528931	0.07
259.2781677	0.96
264.8787842	0.36
271.1798706	3.19
277.4286499	0.22
278.1959839	0.08
286.8581543	0.06
303.0501099	0.09
307.2176514	0.26
321.1307373	0.79
331.1647034	10.89
347.2577820	0.17
349.1978455	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	476.2783
Annotation	PE(18:2(9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
140.1225891	0.06
152.9180908	0.13
190.3651886	0.03
191.1481323	0.03
196.1054840	0.20
214.0919800	1.58
235.0356140	0.04
261.3228760	0.26
273.3305054	0.02
279.3381958	100.00
280.2608337	25.35
282.1805725	0.04
299.1756592	0.12
315.0130615	0.84
316.1590576	0.05
357.3784180	0.03
365.3159790	0.02
377.4558716	0.02
381.0852966	0.05
393.2967224	0.02
402.5310364	0.13
413.1346436	0.18
415.4309998	0.27
419.6113892	0.02
431.3041382	0.06
432.8763123	0.16
439.1885071	0.06
441.2581482	0.05
448.9485168	0.02
458.8214111	0.06
459.5003052	0.35
461.5249634	0.03
476.8981323	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	311.2212
Annotation	trans-EKODE-(E)-Ib
Peak:m/z	Relative Intensity
94.86673737	0.57
95.99719238	0.15
96.99739075	0.48
99.0056839	0.34
104.9891052	0.25
108.0110626	0.30
108.9452286	0.73
110.7756729	0.14
117.0176086	0.46
120.9807892	0.29
123.2325058	0.26
124.9732666	0.69
126.8575592	0.50
130.9677582	0.14
132.9778137	1.65
135.0874634	0.43
137.237793	0.20
139.172821	1.44
141.1248779	0.32
141.9354858	0.17
143.0495605	1.00
145.1037292	0.22
147.1606445	0.49
149.0025635	1.65
151.0648804	0.61
153.0153198	0.74
155.0673828	1.63
157.0549622	0.20
163.062439	0.28
164.9111176	0.45
167.1688232	0.78
169.1688995	2.55
171.1243744	0.18
175.071701	0.36
177.281189	0.17
179.1505127	0.34
180.9941406	0.70
182.9812927	1.25
185.1151123	0.17
186.9008789	0.21
187.9730377	0.24
189.2511444	1.31
190.2429504	0.10
191.1822968	1.18
193.3041534	1.19
195.0915527	3.18
197.0719757	1.92
198.1986694	0.22
199.1325378	0.37
201.3433228	0.35
202.9086151	0.76
205.1149597	0.67
209.1300049	1.12
211.062439	3.86
213.0817261	1.92
215.2312012	1.35
217.1783447	1.47
221.1149902	0.18
222.2565308	0.10
223.2973328	0.64
224.1196594	0.09
225.3188477	1.31
226.1963501	0.12
227.3034973	0.76
230.3024292	0.72
232.2660217	0.22
233.1798401	0.93
234.3217468	0.13
235.1549683	0.85
237.3226624	0.85
239.2471619	2.51
240.6727295	0.63
241.3908997	0.20
247.2606201	2.41
249.3765564	0.90
251.2797852	2.47
253.2306519	6.16
254.223053	0.16
255.3947754	0.81
257.2140198	0.98
265.2672424	2.85
266.4634705	0.29
267.3121033	0.69
269.211792	2.27
270.0709839	0.15
275.2852173	19.11
283.235199	5.07
284.0925903	0.10
287.8744507	0.45
288.7371521	0.34
293.2085571	100.00
293.835083	0.27
298.7751465	0.27
299.8662109	0.48
301.7755737	0.86
310.3566284	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	311.2212
Annotation	trans-EKODE-(E)-Ib
Peak:m/z	Relative Intensity
86.84236145	0.30
88.78281403	0.47
92.07367706	0.52
95.18731689	0.47
97.06370544	0.24
98.07898712	0.43
104.9275589	0.31
107.3398895	0.18
108.9477844	0.44
111.2314682	0.15
113.0073547	0.37
117.1216888	0.87
119.171051	0.24
121.0958862	0.82
123.0852356	1.01
131.1080017	0.38
133.0889435	0.81
134.8895264	0.69
136.9444122	0.69
144.9835205	0.97
149.1981812	0.78
151.1842651	0.97
152.9412842	0.71
155.0390625	2.32
156.9153442	1.51
159.0065918	0.23
161.2611237	0.40
163.1460266	1.30
166.9837646	1.22
168.6176453	1.22
169.2693481	0.18
170.0604095	0.27
171.0026855	0.35
173.1627502	0.31
175.1987457	0.42
177.0608673	1.71
181.213623	1.22
181.9405212	1.01
183.0777588	0.85
185.1783752	0.44
187.2214508	0.42
191.1049194	0.38
192.2854614	0.55
193.1690979	0.92
194.1318665	1.11
195.2337494	4.02
196.9404144	1.04
207.2601929	1.76
209.1483765	0.47
211.1143494	3.12
213.0485229	0.34
215.1099548	0.51
217.3052063	0.30
219.3946838	1.12
220.9963379	0.20
223.2112427	2.70
225.1322327	1.48
226.2176819	0.53
227.0666504	0.84
229.3590393	0.35
231.1373291	0.66
233.2789307	0.54
235.1121826	1.96
237.2011719	1.07
238.153656	0.11
239.223999	0.82
240.5207825	0.24
241.1620483	0.20
246.8670654	0.38
248.5991211	0.20
251.1358032	3.96
253.2027893	5.37
255.1253967	0.89
256.9902039	0.63
265.2345581	2.69
267.2045288	0.42
268.1826172	0.51
269.4111328	2.84
270.2034912	1.43
271.7678223	0.41
275.3451538	15.13
281.3502197	0.82
283.3047791	3.98
293.2094727	100.00
294.1153259	0.84
300.977356	0.59
302.2654724	1.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	355.0983
Annotation	Unknow
Peak:m/z	Relative Intensity
107.9595566	10.26
113.9934006	0.40
115.8651962	0.34
117.7575226	0.17
130.0274658	0.77
131.7894135	0.89
160.0195923	4.31
178.0704041	100.00
185.2197571	0.44
191.0563507	0.16
192.9721069	0.15
199.2264862	0.22
201.8169861	0.33
208.3549042	0.17
218.2222595	0.20
218.8913879	0.14
220.0174561	0.20
224.0866089	0.22
225.7871094	0.39
236.8504639	0.40
237.8944397	0.80
242.1485596	0.58
249.9637451	1.22
265.0652771	19.99
266.2536011	0.15
267.9462891	5.42
273.1868896	1.45
277.0492249	0.31
293.1680298	0.18
293.9805603	0.13
295.1128540	1.01
297.3145447	0.91
313.7473450	0.69
327.2620544	2.24
337.2200928	5.60
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	381.08
Annotation	Lactulose
Peak:m/z	Relative Intensity
103.1400070	0.07
190.8480225	0.08
192.0737305	0.34
208.9755249	0.10
210.9840240	0.26
212.8652344	10.35
249.0568542	0.11
250.9906921	0.41
293.4139099	0.13
294.9326172	0.66
296.7861633	100.00
321.8839417	0.32
334.8658447	42.52
346.5186157	0.03
350.9818726	0.10
362.4300842	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	156.08
Annotation	L-Histidine
Peak:m/z	Relative Intensity
83.0535202	0.28
94.9058075	2.37
109.9219208	100.00
110.8994293	0.10
112.1462402	0.36
137.9633026	0.96
139.0883636	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	407.1721
Annotation	Vernoflexuoside
Peak:m/z	Relative Intensity
115.8102646	0.41
127.9442749	0.13
130.2400360	0.20
141.9185486	0.10
143.1058350	0.43
143.9427490	0.30
159.1461334	1.43
160.0387573	0.07
171.1886444	0.27
172.9254608	0.32
182.4222107	0.09
185.8830261	0.19
187.0441895	0.05
193.0459595	0.28
203.0778198	100.00
204.0351715	0.24
211.2809753	0.08
215.2194214	0.07
216.0946655	0.08
241.1916504	0.84
242.1593323	0.44
254.1503906	0.22
272.2093811	0.36
273.0510864	0.16
274.8141174	0.11
287.1414185	0.18
288.2774658	0.06
301.0028992	0.57
306.1681213	0.46
311.3179932	0.09
315.2129822	0.05
317.0632629	0.15
319.4896851	0.42
325.1183167	0.14
343.0639648	0.14
344.3605652	0.60
345.3144531	0.18
347.0380859	0.18
361.2077942	0.82
362.6214294	0.05
364.4176636	0.19
377.5486755	0.10
379.8184509	0.08
387.5024719	0.06
388.1622620	1.31
389.1255798	1.51
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	703.19
Annotation	6'''-(3-Hydroxy-3-methylglutaroyl)isoviolanthin
Peak:m/z	Relative Intensity
221.0810242	0.10
231.0858765	0.05
234.1955261	0.09
251.1768799	0.10
280.2179565	0.04
323.1814575	0.20
341.0931396	0.37
342.1081238	0.25
359.4288940	0.07
361.3751221	0.05
377.8845215	0.23
379.2925415	0.30
383.3105469	0.67
384.2094727	0.04
412.6852417	0.09
442.9752808	0.24
443.9866943	0.31
445.1786499	0.11
485.2801514	0.35
486.3841553	0.58
487.2816162	0.06
503.2696533	0.63
521.4084473	0.09
523.2620239	0.21
540.2376709	0.50
541.2432251	0.98
545.8963623	0.09
547.4685059	0.13
665.3687134	100.00
666.3463135	88.16
667.3767700	22.46
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	316.2838
Annotation	Dehydrophytosphingosine
Peak:m/z	Relative Intensity
90.9881287	0.13
92.8894043	0.15
94.9689102	1.29
97.0821991	0.23
101.9553986	0.28
104.9052582	0.38
106.8538818	0.26
109.0246964	0.96
110.3677063	0.09
111.0609283	0.33
112.3082733	0.20
115.1734772	0.16
119.1034241	0.58
120.9457550	0.64
123.0626221	1.13
124.4782181	0.20
125.0986633	0.03
125.8034821	0.10
129.1489258	0.08
132.9717865	0.86
135.0802307	1.28
137.0410767	0.91
138.1770325	0.08
139.0635223	0.21
140.4623108	0.10
141.1242371	0.37
147.0608826	0.76
149.0579529	1.03
151.0749207	0.83
154.1376953	0.14
155.1716003	0.06
156.2452698	0.19
157.2294312	0.09
161.1222534	0.82
162.1384583	0.09
162.9323578	0.06
165.2559662	0.20
168.3009033	0.07
175.1026001	0.81
177.1001587	0.24
179.0887604	0.04
181.1948242	0.32
183.1588745	0.04
189.0743408	0.14
191.1738281	0.09
198.4140930	0.25
205.4440918	0.04
207.2599487	1.36
217.2408752	0.19
219.2005005	0.80
221.2210999	1.57
223.5332642	0.19
231.4988708	0.17
233.2415466	3.31
233.8464966	0.05
235.2523804	0.06
237.2825012	0.91
239.1845703	2.29
242.4601440	1.01
245.3413086	1.66
248.9522095	0.12
249.9990234	0.56
251.1183472	3.23
254.1998291	0.20
262.2977295	3.23
263.2751465	1.77
268.3043823	1.89
269.2731934	0.21
270.1041870	0.09
280.3852539	57.40
281.4167480	0.16
286.8425903	0.04
298.3204651	100.00
299.4487000	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	423.9531
Annotation	Unknow
Peak:m/z	Relative Intensity
145.0357666	0.53
182.7614288	0.33
200.6907959	0.47
230.5146790	0.60
235.4797058	0.24
241.4122009	0.24
308.9869385	1.49
310.0526428	0.36
311.0547180	2.94
312.0332031	1.06
314.0935364	0.38
328.1562805	1.17
328.8987122	0.78
350.8482056	0.65
361.5511475	1.16
369.4888000	0.45
377.9594421	0.19
378.6639404	1.83
380.9608459	1.10
381.9504395	0.69
383.8454895	100.00
384.5238342	0.50
396.6058960	0.92
397.3254395	0.35
398.3591003	0.38
399.2843323	0.30
400.7927551	8.56
401.6039124	20.18
402.2599792	0.28
407.3742676	0.43
414.7480164	0.19
417.1345825	0.33
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	959.2017
Annotation	Unknow
Peak:m/z	Relative Intensity
253.3251190	0.60
303.1655273	32.72
327.1811523	0.41
381.1825562	0.39
464.1301270	0.18
465.1356812	42.02
466.2864380	0.60
484.1230469	1.95
503.1260986	0.23
565.1799927	1.54
627.0311890	4.67
642.9915161	0.48
646.3685913	35.29
647.7600708	0.88
665.2924194	1.20
727.1726685	3.72
827.2952271	1.02
878.0863037	2.52
967.3862305	3.60
968.6705933	0.52
1063.9188230	1.10
1129.3447270	100.00
1130.4876710	2.15
1196.7315670	0.20
1200.1779790	0.34
1290.6402590	1.36
1291.2889400	71.75
1292.3145750	1.42
1510.6586910	0.87
1536.1351320	0.31
1560.7236330	0.56
1627.3577880	0.32
1632.4172360	0.15
1639.0789790	1.36
1641.0563960	1.46
1642.8529050	0.37
1675.2073970	0.21
1696.7264400	0.36
1734.4083250	0.58
1741.2198490	0.94
1748.6475830	0.64
1750.9592290	5.18
1764.9484860	4.92
1775.0725100	0.47
1786.0135500	0.98
1792.5983890	1.00
1795.4095460	0.33
1799.0213620	0.54
1807.4180910	0.41
1816.6857910	0.52
1820.5496830	0.30
1822.3682860	0.43
1833.0396730	0.60
1838.9952390	0.41
1841.0441890	0.23
1846.2404790	0.39
1848.5948490	15.98
1850.0598140	0.67
1851.5548100	0.33
1854.2530520	0.26
1859.3338620	0.21
1863.1180420	0.96
1865.1448970	0.44
1867.5750730	0.39
1871.4201660	0.23
1876.1658940	0.54
1887.1151120	2.77
1891.4696040	0.37
1894.8111570	0.21
1895.4666750	0.44
1896.8905030	0.99
1898.8648680	3.69
1904.8415530	1.18
1906.0579830	0.23
1908.6301270	0.67
1911.5662840	1.32
1912.7901610	5.42
1913.5490720	0.45
1914.3464360	0.78
1917.3015140	0.27
1921.2863770	0.70
1922.9094240	0.59
1928.4865720	1.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	392.1133
Annotation	(gamma-Glutamyl-gamma-glutamyl)-S-methylcysteine
Peak:m/z	Relative Intensity
118.9777069	0.05
126.9041672	0.04
128.0390320	2.30
135.1010895	0.18
143.0364838	5.16
145.0594482	0.06
146.0548248	0.77
153.1401672	0.05
166.1647644	0.03
167.1387329	0.55
171.0413208	0.33
177.0064392	0.47
179.1045380	8.04
185.1867371	0.08
197.0816650	1.10
210.1947174	5.23
213.1600952	0.06
228.2755432	0.48
231.1008301	0.09
236.1367493	0.44
254.1194763	73.49
254.8825378	0.06
263.1683655	6.23
272.1296997	100.00
288.0592957	5.04
298.6195374	0.06
306.2288513	44.42
317.6087646	0.05
374.1469116	18.02
374.7572937	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	470.107
Annotation	Tuberosinone N-beta-D-glucoside
Peak:m/z	Relative Intensity
162.1323547	0.09
170.1526489	0.05
177.1144714	0.12
179.0003052	0.52
187.9743500	0.10
201.9558258	0.40
210.9951172	0.19
217.1819153	0.24
219.1432190	3.89
229.2221527	0.09
251.1359558	2.40
272.1112976	0.12
273.3131104	0.30
289.2030945	0.21
301.2086792	0.12
303.1483154	0.11
305.1138916	0.04
306.0529480	0.03
307.1614075	0.18
327.1733398	0.12
330.1817627	0.92
341.0585327	4.78
342.7795715	0.06
346.4077148	0.09
348.2156982	100.00
362.1325989	0.03
364.4265747	0.09
379.0094299	0.05
380.1305847	9.98
380.7550354	0.02
395.1184387	0.21
405.9281921	0.19
412.0502625	1.26
419.5243225	0.04
452.0135193	0.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	523.11
Annotation	3,4',5,6-Tetrahydroxy-3',7-dimethoxyflavone 3-glucuronide
Peak:m/z	Relative Intensity
175.0797119	0.19
212.9317169	3.40
251.3034668	0.38
298.4752808	0.28
348.8994141	100.00
349.5177612	1.24
356.5202637	0.62
386.8474731	5.46
438.9010620	0.17
445.1781616	0.29
521.8687744	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	476.2781
Annotation	PE(18:2(9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
153.0400696	0.17
196.1352234	1.66
196.9706268	0.25
205.0954590	0.05
214.1461792	1.41
215.3990479	0.05
223.2507324	0.07
233.0797577	0.05
242.5807953	0.10
261.2999878	0.25
275.9508972	0.08
277.6587524	0.05
279.3118286	100.00
280.2973328	24.17
280.9180603	0.06
281.6857910	0.18
296.9951172	0.12
300.2804565	0.11
305.5795898	0.13
311.2040710	0.15
314.4273682	0.55
315.2092285	1.26
321.1310425	0.04
325.4268799	0.03
349.7397156	0.07
360.4346924	0.07
373.2907104	0.03
377.2996521	0.12
392.9687805	0.14
409.2081604	0.07
413.2102356	0.13
415.3003540	0.40
431.1803284	0.19
432.7120667	0.14
433.6715698	0.17
440.0456848	0.12
441.4719543	0.03
442.2122192	0.04
449.5258484	0.05
457.3294373	0.20
458.9400330	0.50
459.9358826	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.11
Annotation	Unknow
Peak:m/z	Relative Intensity
96.9017944	0.10
98.9764252	0.05
100.9648743	0.97
102.8994446	0.13
113.0390320	2.97
114.8338852	0.27
118.9438553	1.82
124.8958435	0.58
130.9371490	3.96
142.9908752	1.91
148.9922791	100.00
149.8868866	0.05
160.9445038	2.67
173.3533936	0.04
178.9190979	12.75
188.9383545	0.10
240.9767456	0.19
243.1114502	0.53
268.9798889	0.06
279.0368347	0.26
280.0172729	0.06
281.0048523	0.34
284.8874512	0.04
322.9410400	3.64
327.2510376	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	725.1929
Annotation	Sachaloside III
Peak:m/z	Relative Intensity
229.1226044	0.04
239.9527130	0.15
271.2121582	0.06
272.0431824	0.11
273.1768188	0.07
274.3852844	0.08
300.5123901	1.75
301.1316223	27.67
302.1679077	2.85
315.2811279	0.15
321.1498718	0.04
379.2854614	0.07
427.0172729	0.05
433.1881714	0.04
445.3361816	0.90
446.1931763	0.05
448.4605713	0.24
463.2171631	100.00
464.2875977	10.29
465.4986572	0.05
505.2124023	6.40
506.2194824	0.84
519.4292603	0.39
520.0809326	0.07
545.4053345	0.04
563.2113647	75.76
564.3099976	10.04
586.0108032	0.05
605.2122192	0.14
607.2958374	2.10
608.4880371	0.12
619.3175049	0.11
622.3193970	0.13
625.4940796	0.91
662.3858032	0.06
667.2287598	5.56
668.3705444	1.83
679.1113892	0.07
681.3771362	0.16
682.3374634	0.20
702.7562256	0.15
707.3370972	0.74
716.5982666	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	297.24
Annotation	cis-9,10-Epoxystearic acid
Peak:m/z	Relative Intensity
92.91992188	0.18
96.76271057	0.12
108.9634552	0.42
119.0318527	0.27
143.0413666	0.31
155.9516296	0.48
167.2502899	0.31
170.0418549	4.11
175.1963348	0.26
183.0126953	100.00
184.0028992	9.87
185.1026154	0.21
190.1763153	0.53
195.1736145	0.27
197.1111145	3.05
198.1275024	2.18
199.1186829	1.30
211.0991516	1.10
212.0325623	5.30
213.3179321	0.23
223.3160706	0.66
225.1522827	5.75
226.0754089	2.03
227.1502991	0.33
231.4637451	0.09
233.2021179	4.19
234.4082336	0.31
236.9450684	1.02
237.6082764	1.12
239.1578369	2.45
240.0581055	2.02
241.0419922	0.37
241.7362061	0.25
248.1312256	0.35
251.1932373	1.37
253.2847595	46.81
254.0928955	0.07
259.9716797	0.26
261.9732666	1.40
267.8291016	0.55
269.1901245	1.15
279.3201294	24.11
281.2052002	0.65
282.6181335	0.13
297.3304443	8.37
298.196167	1.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	302.2683
Annotation	Unknow
Peak:m/z	Relative Intensity
100.8635101	0.36
135.1158142	0.14
137.0580750	0.07
140.0171204	0.12
147.8977356	0.37
148.9261780	0.06
161.1354065	0.21
162.0355530	0.39
163.1929474	0.09
165.3042908	0.15
174.0545502	0.09
175.1972961	0.31
178.2322540	0.11
200.2367859	0.65
201.1676636	0.12
202.7187195	0.16
204.3965759	0.21
207.3380432	0.21
208.9293518	0.20
214.2444458	0.37
217.1221008	0.13
222.0965576	0.14
223.0822449	0.23
226.6529236	0.09
228.0248718	0.30
228.9587097	0.23
231.3562927	0.14
232.2635193	0.22
236.9179077	0.14
238.7772217	0.46
246.2538452	0.16
248.5813599	0.93
249.2329102	12.77
249.8399963	0.09
250.5306396	0.27
253.2660522	1.07
255.1558533	0.15
256.6512756	0.21
257.6676025	0.66
259.5415955	0.25
260.4566650	0.37
261.1565552	0.25
266.3398743	29.05
267.3651733	0.57
271.1885986	2.73
274.2843628	0.94
284.1277466	100.00
284.9955444	2.04
290.2966309	0.37
293.1120605	1.28
301.1069946	0.12
302.2160950	0.50
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	608.12
Annotation	Unknow
Peak:m/z	Relative Intensity
169.8118896	0.08
175.0119781	0.04
179.0087585	0.25
180.9929962	0.07
183.2796936	0.25
201.9341583	1.18
205.5028992	0.15
209.0203857	0.07
210.0106354	0.12
217.2238922	0.05
219.0846558	1.65
220.3466949	0.08
225.0463562	0.09
228.0705261	0.28
245.0233612	0.10
249.0451508	0.07
255.2071838	0.14
261.0663757	0.06
265.2267456	0.04
266.1339722	0.04
273.1471558	0.12
274.0083923	0.05
282.8132629	0.07
285.1118164	0.10
290.8093262	0.06
292.2851562	0.04
299.1365051	0.08
300.9667053	0.06
308.2968750	0.04
313.1595459	0.27
314.9493408	0.04
319.6425171	0.13
323.2456665	0.04
330.2420654	0.69
348.1804199	22.34
349.1179199	0.43
368.2623291	0.07
370.7847900	0.18
377.9265747	0.02
380.1530762	0.18
389.0881958	0.06
391.9403076	0.05
397.1132202	0.24
412.4816895	0.66
413.2708130	1.75
414.3577271	0.04
418.4440308	0.04
428.2260132	0.02
430.1492920	0.55
444.0241089	0.42
444.8936157	0.20
445.8146973	0.08
452.3737793	0.15
458.9428101	0.13
459.8555908	0.09
460.8210449	1.32
461.5496826	0.26
470.2921143	0.97
471.4172974	0.15
476.8366089	0.06
478.0279541	3.91
479.1060791	0.92
484.2407837	0.13
486.3596802	0.43
502.3313599	0.18
515.2892456	0.17
516.0397339	0.12
517.1442261	0.04
518.2966309	0.24
519.1111450	0.16
521.5569458	0.07
526.3455200	0.06
532.1027222	0.17
534.2429810	0.33
536.4873047	0.12
543.4069214	0.03
546.2310791	0.10
550.4058228	0.14
559.5548706	0.19
561.0966187	0.03
564.4518433	0.08
566.4661255	0.09
571.3165894	0.10
575.4747925	0.23
576.2854614	0.17
580.3671265	0.04
589.9978638	100.00
590.7373657	0.55
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
87.9044495	0.07
89.9211731	0.06
118.7058868	0.02
136.0116272	23.14
140.0429840	0.02
146.9898071	0.11
164.9630737	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	272.96
Annotation	Ribose-1-arsenate
Peak:m/z	Relative Intensity
114.9884872	4.76
130.9556274	0.20
156.2818298	0.03
158.9523010	100.00
198.9745483	2.17
217.0173035	1.45
227.6838074	0.02
229.0047913	28.50
245.1365967	0.62
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	246.12
Annotation	4-Acetamidoantipyrin
Peak:m/z	Relative Intensity
84.0200882	12.09
85.84197235	4.18
95.96264648	5.01
97.81590271	3.73
100.0910187	1.34
112.12677	1.67
113.712265	0.54
120.9131927	0.60
125.0960999	1.17
125.884079	1.28
136.2301331	1.11
141.7984009	2.30
143.1914978	1.40
154.9673157	2.81
156.1277008	31.85
163.1921082	1.63
165.2970428	2.93
166.1932526	1.40
168.282959	1.64
173.1542664	3.23
174.0454712	2.70
175.2067413	2.58
180.0004578	3.11
182.1356354	2.47
184.3139191	2.11
186.0648956	7.43
192.3786774	0.87
198.2744598	4.66
199.1040344	7.77
200.0610199	16.01
202.1159515	4.58
203.1610718	0.71
204.9291077	10.61
206.1897125	0.65
210.0582733	2.49
214.5737457	4.65
215.7878265	2.76
217.7042694	1.33
218.3110962	5.34
219.0344391	1.96
222.5630951	5.64
224.7501678	2.27
228.1078033	100.00
228.7947998	1.18
237.0535278	21.37
237.801651	2.39
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	465.1016
Annotation	6-Hydroxytricetin 5-rhamnoside
Peak:m/z	Relative Intensity
144.9912109	0.06
303.1423950	100.00
304.1815796	0.03
305.1293945	0.05
327.3032837	0.01
331.2744751	0.01
345.1072693	0.22
369.1600647	0.13
399.3948059	0.01
429.5764771	0.10
440.5835266	0.01
447.3700256	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	391.2829
Annotation	Di(ethylhexyl) phthalate
Peak:m/z	Relative Intensity
149.0266876	100.00
149.9102783	48.08
166.9085693	30.87
178.0857239	6.99
243.308075	6.58
260.7299805	15.86
261.7612	35.55
278.7790222	28.90
279.7208557	22.05
280.3636169	4.60
305.225708	17.14
347.1747742	20.67
360.9736023	9.44
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	431.1193
Annotation	3'-O-beta-Glucopyranosyl plumbagic acid
Peak:m/z	Relative Intensity
145.1242523	0.09
193.0687408	0.07
207.1908417	0.12
208.1569824	0.05
223.1231689	19.66
235.2296753	0.06
245.0670776	0.06
272.2923584	0.17
274.6473999	0.23
283.4124146	0.16
285.4367065	0.08
301.1182251	0.05
304.2175293	0.06
304.8952026	0.33
309.9771423	0.10
311.1805725	0.13
312.1515808	0.55
313.4359131	0.07
314.3479614	0.18
333.4729919	0.08
343.1760559	0.17
344.1646729	0.55
366.2378845	0.09
370.0883484	0.07
371.2640381	0.46
383.3285217	0.07
385.2647400	100.00
387.2276306	0.18
391.2052307	0.88
393.2333679	0.17
401.3019714	0.15
411.0973816	0.06
412.3500366	0.15
413.3491516	0.62
414.2309265	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	342.2995
Annotation	C-2 Ceramide
Peak:m/z	Relative Intensity
105.0226898	0.04
109.1195145	0.04
119.0416412	0.10
120.9881516	0.54
123.0640717	0.23
133.2406769	0.20
134.9657898	0.05
136.8586121	0.02
140.0496216	0.06
142.8026581	0.11
145.0906067	0.06
147.2569275	0.15
148.9891968	0.37
154.0301208	0.06
162.9886169	0.13
165.3624573	0.08
165.9995575	0.05
169.1528015	0.04
173.0475922	0.03
174.858902	0.04
177.4830017	0.11
178.9573212	0.23
182.2898865	0.10
183.6442108	0.05
186.026062	0.11
187.2466736	0.16
189.0334778	0.19
193.0571899	1.47
207.0622711	0.19
215.5133057	0.06
233.460144	0.06
243.0618286	0.20
245.4591064	0.23
247.249176	1.33
251.6022949	0.12
253.4043884	0.26
259.3217468	0.14
261.2428589	0.49
263.2796936	1.33
265.3243408	0.06
268.3603516	0.10
271.3795471	1.97
277.3555298	1.08
289.3644409	16.98
294.2250366	0.11
306.3063965	18.71
307.3388977	0.45
324.2982483	100.00
340.1243896	0.11
341.4334412	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	348.04
Annotation	Glucolepidiin
Peak:m/z	Relative Intensity
98.8915405	0.47
101.0851517	0.64
115.0874939	0.62
115.8123093	1.18
118.1311951	0.42
120.9860229	0.74
130.8537903	0.98
140.2445679	0.32
144.9125366	1.99
146.8096008	1.28
147.9111328	0.60
152.8195801	0.89
162.0662994	53.81
170.0491028	0.79
175.1016541	0.67
176.9968567	1.18
178.8735352	2.03
194.0137787	100.00
195.0338287	2.50
210.0388641	14.74
211.9956665	0.46
214.5016174	0.89
219.1221313	0.85
221.1000061	1.14
226.0444641	0.63
226.8215942	6.79
241.9289856	0.52
248.3619080	0.96
249.1547241	0.35
257.9405518	7.24
258.9726868	0.81
268.2908936	0.36
269.8929749	0.57
271.4331665	0.49
284.3096924	0.51
294.4813843	0.45
298.1891174	0.49
301.0233154	0.42
302.5094604	0.62
310.8165283	0.94
313.7402649	0.77
315.0049438	1.53
316.1129150	2.32
319.3948669	0.84
320.1718445	0.30
329.3839722	0.62
330.0371399	1.45
330.8460388	2.75
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	566.02
Annotation	Unknow
Peak:m/z	Relative Intensity
162.0122528	0.20
170.4134674	0.46
171.0566254	0.59
172.0687561	0.06
179.0630646	0.76
183.0365906	0.16
184.2808228	0.36
188.4223328	0.19
190.9848938	0.15
202.1254578	1.37
217.1277618	0.23
218.9859619	16.98
225.9507446	0.10
226.6780396	0.08
245.1195068	0.67
249.2924805	0.38
249.9963074	0.47
251.1736450	0.57
258.4385681	0.22
263.0635681	0.12
266.0732422	1.01
267.1269226	1.33
272.5667114	0.15
273.3128662	0.64
274.1096191	0.27
275.2482300	0.07
278.2427979	0.30
281.1186829	0.48
281.9333496	0.19
282.9600220	1.59
291.2586060	0.20
292.9854126	0.16
303.1049805	0.16
306.8723755	0.45
308.4433594	0.12
310.2760620	0.14
311.1570740	0.20
312.8927612	0.48
315.2927856	0.63
323.4271240	0.33
325.2702026	0.34
329.6868896	0.10
330.5397339	0.50
331.1881104	0.16
333.9759521	1.00
338.1656494	0.08
339.1602783	0.31
345.2605591	0.38
346.9016113	0.70
348.2188721	8.88
357.0715942	0.25
366.9262085	0.46
367.8673096	0.07
370.1473389	0.28
371.0361328	0.77
378.6823730	0.26
379.2998047	0.14
380.1085205	0.06
385.3849487	0.39
394.1644287	0.20
396.4023438	0.41
404.1188354	0.28
405.1046753	0.31
411.1269531	0.25
413.0134277	4.17
414.1625366	0.41
419.1284790	0.39
436.9952393	100.00
437.6013184	1.24
444.0552979	0.23
446.1534424	0.29
453.1672974	0.21
454.1866455	1.73
458.1456299	0.16
473.2796021	0.52
475.9225464	0.34
486.2192383	1.45
491.1925659	11.88
519.1358032	0.17
523.5294800	0.33
534.3389893	0.22
535.5071411	0.12
536.3338013	0.13
544.5206299	0.68
547.9597778	23.34
548.6007690	0.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	553.16
Annotation	Unknow
Peak:m/z	Relative Intensity
166.0941315	0.29
234.4652863	0.33
247.1600037	0.78
264.2134705	0.41
265.2246704	0.98
281.8689575	0.43
285.0186768	0.65
290.0627441	0.72
297.1526184	0.36
312.1496582	0.18
319.2343750	1.19
334.1598511	6.62
371.4051514	0.84
387.1529541	0.27
394.2265625	0.34
400.8247681	1.06
403.4745483	0.24
406.5087280	0.77
415.0280151	0.49
419.4417114	0.18
423.9945068	1.76
437.3688965	0.72
443.6651001	0.49
445.3021240	0.68
460.0700684	0.36
463.3016357	100.00
474.8034668	0.68
478.5381470	0.11
487.8483887	0.31
506.1199951	0.20
516.7482910	0.56
531.7316284	1.65
534.2702026	1.60
535.4450073	2.77
536.5022583	0.89
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	549.1677
Annotation	Unknow
Peak:m/z	Relative Intensity
161.1871643	0.06
178.8936615	0.02
204.8911438	0.02
341.3128052	0.09
484.8253784	0.06
503.3505249	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	311.2209
Annotation	trans-EKODE-(E)-Ib
Peak:m/z	Relative Intensity
86.78887177	0.36
95.38439178	0.33
100.8940735	0.45
105.0423431	0.21
109.0600586	0.74
116.8917542	0.13
125.1891556	0.33
126.9670105	0.21
133.0984802	0.33
135.0427246	0.66
139.0152588	2.68
140.9796143	0.41
143.0852051	1.02
148.9926758	2.07
151.1073303	0.09
153.0956421	1.07
154.946106	0.84
156.0931091	0.41
156.9891052	1.86
158.8288879	0.56
163.0545044	1.49
164.9393616	0.23
166.9653931	1.57
168.1686707	0.34
169.0560455	0.58
171.0138092	0.74
177.1858063	2.10
178.9117584	1.05
180.1117859	0.73
181.0726624	1.02
183.2079163	1.51
184.1069946	0.21
184.9885712	0.56
187.0466003	0.26
191.0562134	0.80
193.0268097	3.17
195.0645447	0.90
197.29245	0.68
200.9745941	1.17
202.0089417	0.21
203.1925354	0.38
205.0602417	1.42
207.2164612	1.30
209.2186279	1.22
211.2380676	3.62
212.283783	0.41
213.1743774	2.42
214.058136	0.52
215.1058655	0.16
217.1655884	0.48
218.2635498	0.21
221.270752	0.18
225.2049255	3.23
226.2247314	0.88
227.4724121	2.94
229.2910767	1.63
235.1421509	2.39
237.1418457	0.39
239.1719971	0.40
241.1616821	1.24
246.3119812	0.16
247.1957703	0.36
248.5948486	2.46
250.3270874	0.41
251.2262573	3.39
252.3131714	2.24
253.1430054	7.39
254.9555054	0.29
257.1691284	1.95
265.0422363	2.74
266.6654663	1.25
267.4450073	1.00
269.2849121	1.47
272.3411255	0.78
275.3405762	18.81
280.6145935	1.70
283.2393799	5.05
290.9816589	0.20
293.2191772	100.00
293.9302673	0.31
295.4525146	0.33
301.6620178	1.47
302.557373	1.52
311.3538513	1.41
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	277.1023
Annotation	C20912
Peak:m/z	Relative Intensity
83.9290848	1.80
101.9925079	2.47
121.1404419	0.05
130.0390472	16.86
131.0370483	0.24
139.1763000	0.07
148.0227356	100.00
148.9444580	0.03
158.1007843	0.15
175.0225525	0.13
176.0121765	0.13
199.0875854	1.58
204.8643188	0.10
214.0917969	1.35
218.9978943	0.07
228.5608826	0.04
231.2452393	0.10
235.1550598	2.55
235.9454041	0.11
240.9578247	0.79
246.9720154	0.10
259.0683899	4.59
260.1591187	7.89
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	503.1617
Annotation	Unknow
Peak:m/z	Relative Intensity
143.0385284	6.56
149.0393372	0.59
155.0917206	0.63
158.9684448	2.64
161.0299377	13.80
172.9219666	1.59
178.9159393	100.00
189.0388184	0.31
197.2781830	0.43
201.3291931	1.98
214.6240845	0.31
215.2503357	0.85
221.0726624	54.72
232.7479248	1.98
244.8355408	1.23
249.0724182	0.95
250.7405701	16.17
263.1554871	3.96
281.0580139	3.36
305.3574829	0.86
310.8768921	5.49
323.1567688	49.03
339.7100830	0.35
341.2216797	41.39
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
171.1553802	1.71
179.0845184	0.71
197.1646118	0.13
215.0805817	1.34
253.1743927	0.13
270.1710205	0.06
271.1466064	2.77
289.1013794	100.00
560.6349487	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	563.14
Annotation	Vicenin 1
Peak:m/z	Relative Intensity
167.1343079	0.04
179.0462646	0.96
193.0464783	0.06
215.1987915	0.02
229.0589905	0.07
230.2845001	0.04
239.1866455	0.04
257.1656799	0.27
263.2846069	0.02
272.9960327	0.37
274.3062134	0.02
281.2052002	0.03
294.4505005	0.02
301.1238403	100.00
302.1179199	14.29
304.9696655	0.01
315.1972656	0.11
321.1535034	0.06
322.0284424	0.03
327.7171631	0.01
337.2532959	0.02
343.5449219	0.03
349.8669434	0.02
371.3609009	0.04
384.2360840	0.02
397.7736206	0.02
406.3429565	0.01
408.5670776	0.03
427.3960571	0.03
445.1807861	0.97
446.3239136	0.34
459.3724976	0.02
461.6990967	0.01
463.2423706	0.27
464.2462158	0.12
468.1059570	0.02
473.9371338	0.05
491.3963013	0.02
499.2723389	0.05
501.3193359	0.06
505.2116699	3.28
506.2478638	0.82
517.4483032	0.08
519.1195679	0.35
520.2606201	0.11
528.1544800	0.06
533.4661255	0.03
545.3045654	0.23
546.3765259	0.18
548.8827515	0.08
554.7568359	0.08
555.4365845	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	381
Annotation	Unknow
Peak:m/z	Relative Intensity
155.6780701	0.43
193.9775543	0.34
206.0381317	0.45
209.0527649	8.91
209.9651184	0.83
211.0401764	5.15
212.8155823	8.03
219.2902222	0.18
248.1249084	0.47
251.1125793	2.37
254.0508118	0.75
295.1128235	1.93
296.8299561	100.00
306.0460205	0.22
334.8161621	41.75
337.9280090	0.17
353.2148743	0.13
362.1434021	1.33
363.3175354	2.71
364.1453247	0.49
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	378.0977
Annotation	S-Lactoylglutathione
Peak:m/z	Relative Intensity
111.0373383	0.05
125.1527481	0.04
126.9982986	0.03
127.9986572	1.44
135.0995178	0.06
143.0231323	3.21
145.0715179	0.07
146.1188049	0.56
160.0832214	0.18
166.0213470	0.15
166.9707947	0.24
169.1362915	0.03
170.0861206	0.02
174.0430603	0.04
176.9610596	0.57
179.0559692	3.61
181.1643066	0.04
184.9037170	0.13
192.1846466	0.03
197.1473694	0.48
210.2032166	1.49
213.1898499	0.03
215.1356812	0.25
215.9895782	0.10
228.1196289	0.15
231.0920105	0.19
236.0816650	0.11
246.2449646	0.09
249.0737610	3.69
252.9889526	0.10
254.1163330	43.40
272.1659241	72.11
274.1357117	0.06
288.1511536	7.50
306.1646729	100.00
306.9271851	0.03
315.2470703	0.06
331.9018555	0.10
333.1326294	0.04
341.2919312	2.93
342.1587524	0.15
360.2024841	16.60
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	543.1307
Annotation	Galactotriose
Peak:m/z	Relative Intensity
201.0999146	0.07
219.0846558	0.05
232.3191223	0.10
325.1256104	0.11
363.1611938	3.88
364.1057739	0.28
372.3753662	0.13
381.1586914	100.00
382.2783203	13.28
382.9996948	0.22
443.2651367	0.07
453.0613403	0.20
454.5856323	0.13
482.9483643	0.07
500.9727173	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	923.442
Annotation	Nostophycin
Peak:m/z	Relative Intensity
665.6655884	0.05
725.1467896	0.02
741.7036133	0.31
742.4476318	0.07
774.2943726	0.08
777.4572754	0.05
880.0996704	0.08
887.6276245	100.00
888.5647583	20.40
889.2316284	0.28
904.8678589	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	333.21
Annotation	5(S)-HpEPE
Peak:m/z	Relative Intensity
97.23812866	0.38
103.141571	0.28
106.9421082	0.51
109.1451416	0.32
128.9487305	0.45
131.0336151	0.25
145.4045105	0.58
157.8801575	0.23
175.220871	0.64
195.4495239	0.64
204.2123718	0.59
213.2043457	0.32
214.1535645	0.66
219.2484131	0.28
221.4075928	1.12
225.1430664	0.43
226.0332336	0.98
237.1451111	0.62
246.9837341	0.51
252.9888306	0.77
255.2745361	8.13
256.7345886	0.35
263.3076172	0.21
269.6066589	0.71
271.3470764	10.76
273.3400269	1.22
277.202179	0.21
277.8923035	0.17
287.1212158	4.36
287.9822998	0.65
289.1583862	1.93
289.9456787	0.38
295.9500427	0.40
297.1752319	9.13
299.1104736	0.91
303.0456543	0.47
305.4358826	1.35
315.1990356	100.00
315.8526611	0.94
316.6847229	0.96
317.3286133	0.34
332.8065186	0.41
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	205.0966
Annotation	Indoleacrylic acid
Peak:m/z	Relative Intensity
97.0282593	0.01
131.7870636	0.01
156.9913025	0.01
159.1068268	0.11
176.8801422	0.01
182.1606598	0.02
188.0181427	100.00
189.0414276	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	506.09
Annotation	Unknow
Peak:m/z	Relative Intensity
192.9839783	2.21
255.2432556	1.43
260.0905151	0.28
272.1637878	0.50
285.7839050	0.87
311.4044189	1.05
312.6935425	0.88
313.3479614	2.54
357.3907471	0.46
375.0502930	0.82
375.8849487	0.66
376.9935913	2.51
413.1296082	43.54
414.1545105	32.94
415.1448669	100.00
416.3417358	7.20
417.2123718	7.26
428.7185364	0.43
460.1369934	0.67
470.2232056	0.93
473.0245972	1.30
486.9813538	0.53
489.6473083	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.109
Annotation	D-Galactofuranose
Peak:m/z	Relative Intensity
100.9613953	7.30
105.9048004	0.08
106.8093719	0.16
109.0246735	0.10
113.0120697	15.74
114.9397888	0.67
118.9804688	14.31
124.9789734	2.60
131.0097656	7.70
143.0045624	19.62
148.3958282	0.63
149.0371399	2.45
159.0889893	0.23
161.0795898	20.19
178.9631958	100.00
180.9597321	0.13
209.3267517	0.11
221.2214966	0.49
242.1772766	0.18
244.9953308	0.10
251.0961304	1.24
281.0144348	2.51
297.0783691	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	636.27
Annotation	GW 6471
Peak:m/z	Relative Intensity
182.8649902	1.16
199.1131592	1.73
205.1373749	0.68
222.8221741	2.17
235.3010712	0.39
246.8271179	0.28
252.9369812	6.91
258.3983765	0.70
259.0488281	6.83
271.0872192	3.84
276.8617249	2.98
287.5966492	0.44
288.9494019	22.17
294.0021973	3.01
307.0158997	4.57
311.9761963	3.72
313.3521118	0.75
324.9906616	100.00
336.6221924	0.80
340.0238647	0.63
340.9354248	3.02
342.8338623	28.15
443.5816650	0.99
456.1532593	4.04
464.8798828	1.70
474.1068726	27.69
486.3867188	2.72
487.0655518	10.28
494.5049438	0.89
501.1189575	0.89
503.5792847	0.28
504.2405396	0.54
505.1179810	1.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	646.1278
Annotation	Unknow
Peak:m/z	Relative Intensity
303.2185059	13.71
304.0244141	4.16
403.2055664	10.01
414.1648560	2.50
428.0697632	3.09
465.2025757	45.65
465.9984741	10.53
466.6009521	1.04
484.3526611	87.49
485.2593994	5.26
486.4420776	0.72
503.1932983	7.88
518.0681152	0.84
521.5361938	2.82
565.3855591	100.00
566.3474121	10.46
567.2414551	2.80
575.2940674	4.37
665.3170776	69.38
666.2939453	17.61
667.5474243	1.30
805.3297729	9.25
806.3628540	4.11
827.4917603	3.21
949.4266968	0.95
967.2754517	60.95
968.4287720	19.59
1129.3388670	36.59
1130.3345950	10.98
1131.1159670	3.58
1184.5173340	2.89
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1004.3132
Annotation	Unknow
Peak:m/z	Relative Intensity
545.0809326	0.07
665.0970459	0.14
827.3985596	100.00
828.5369873	0.11
829.5023193	0.70
986.2457275	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	989.3218
Annotation	Lantanose B
Peak:m/z	Relative Intensity
305.3066406	0.30
306.3666382	0.29
323.2502441	1.09
340.7008667	0.94
341.3352051	1.79
342.0722961	0.14
381.3060913	0.49
383.2626343	9.06
384.2980652	0.28
398.1676941	0.42
411.2412720	0.13
415.9966125	0.22
449.3085327	0.23
467.2404480	0.25
479.0088501	0.52
485.3350220	9.68
486.5852661	0.97
503.3219299	6.68
504.3407593	1.72
527.3984375	1.19
543.3819580	0.18
545.3027954	100.00
546.2888184	21.86
557.3748779	0.50
569.5194092	2.51
575.1847534	0.42
587.5126953	0.23
618.2236938	0.14
635.8972168	0.40
647.2482910	15.51
648.3590088	3.37
665.4676514	13.55
666.4387207	3.23
705.8917236	0.80
707.3787842	69.89
708.4307861	21.42
731.4228516	0.59
739.3162842	0.55
740.4245605	0.37
750.5517578	0.68
762.8374634	0.96
773.5776367	0.28
809.4171143	13.57
810.3458252	7.43
827.3950195	65.60
828.5307617	29.87
869.3267822	3.02
870.4019775	0.45
881.0738525	0.20
899.5968018	2.07
900.3892822	0.42
971.7088623	0.81
972.5035400	1.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	355.1
Annotation	Unknow
Peak:m/z	Relative Intensity
150.0590820	4.17
151.0380249	0.26
154.1623840	1.17
160.1116943	0.85
174.7559357	0.37
189.1710663	0.79
194.1055145	2.67
196.8995361	0.61
205.1530762	1.21
206.0434723	0.96
206.9418335	0.26
225.8639526	0.81
239.4102783	0.76
243.6712036	0.44
248.8511658	0.56
250.2342529	0.69
259.2275696	1.26
264.7379150	1.20
275.1362915	0.69
276.3712158	0.81
279.4710388	0.89
281.2919006	1.61
282.4018555	10.43
283.1889343	29.16
287.4885864	0.61
291.0891724	0.24
292.2159119	0.26
293.2592468	3.21
294.3654785	1.56
297.2622070	2.03
310.3137817	9.94
311.3135071	12.05
313.8958130	0.54
317.3650818	1.20
323.1122437	100.00
327.1321106	0.97
331.9613037	1.07
334.1736755	2.84
336.1253052	0.82
337.3281250	4.35
354.6885071	0.32
355.3836670	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	654.1138
Annotation	Unknow
Peak:m/z	Relative Intensity
192.0795135	0.19
271.3135681	0.44
303.2423096	22.46
304.2107849	0.77
305.2234497	0.13
311.5001831	0.45
325.2220764	0.48
465.1859131	66.93
466.3190918	8.66
467.4533081	0.39
479.0357056	0.19
483.1876221	0.28
489.4420166	0.30
491.7135620	3.12
493.4784546	0.68
496.9034424	0.08
518.1826782	6.77
519.1497192	13.80
520.2855225	0.71
552.3606567	0.15
573.1705933	2.18
573.8605347	0.07
574.6592407	0.24
575.9916992	0.44
604.0512695	0.21
606.0480347	0.43
614.9782715	0.34
626.9951172	25.63
627.9033813	1.15
629.0296631	0.98
636.2551880	0.47
637.7958374	0.27
646.1253052	0.45
654.4508667	0.09
659.4641724	0.83
660.4591064	0.31
679.5938721	1.60
680.4175415	26.02
681.2352905	100.00
682.3353271	6.84
697.6925659	0.09
698.8198242	0.33
700.8829956	0.34
789.4121704	0.72
820.0542603	3.76
820.9819946	6.44
821.7475586	0.27
822.4677734	0.29
828.7005005	0.83
842.3070679	3.12
843.2070923	10.17
844.2989502	0.78
936.0773315	0.17
982.1779785	18.56
983.0930176	33.08
984.1508789	8.55
1005.2506710	0.69
1006.1154170	0.36
1035.5908200	0.17
1144.4040530	9.28
1145.1929930	17.83
1146.1029050	3.44
1146.7197270	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	272.089
Annotation	Unknow
Peak:m/z	Relative Intensity
85.0098419	0.06
86.0320206	0.38
99.0418549	0.45
125.5104675	0.09
127.9655457	18.22
135.2733765	0.04
143.0828552	23.78
144.0562439	0.03
145.0590210	0.91
146.0661163	3.13
153.0268707	0.32
166.0583191	0.25
167.1391754	0.70
170.1277008	0.20
179.0244141	24.31
181.3101654	0.09
183.2239380	0.10
185.0852051	2.81
192.0323792	0.33
193.0351562	0.05
197.1038971	1.70
208.0692291	0.10
210.1553497	14.84
211.3383026	0.04
212.3749542	0.05
228.1349030	1.12
236.2011871	0.55
254.0753784	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	419.04
Annotation	Unknow
Peak:m/z	Relative Intensity
128.0357361	0.26
142.0220642	0.12
144.0355072	0.25
159.2399750	0.13
162.9835205	0.11
163.8734131	0.18
184.0608826	0.11
184.9869080	0.32
186.7818146	0.49
188.1023254	2.24
202.0198059	0.08
205.0795593	5.55
214.9128418	0.27
241.2209778	0.06
245.1914368	0.46
247.0049744	0.24
249.1636658	0.30
255.1000671	0.67
255.9417114	0.45
259.0650940	0.09
273.1701965	0.13
290.1846619	1.03
291.1482544	0.07
292.1249390	0.22
298.4052124	0.43
304.1153870	0.20
311.9730225	0.44
314.2716064	0.82
326.2777710	0.41
328.0624084	1.17
329.8855591	0.24
333.3278809	0.19
337.9969788	0.83
352.2317200	0.63
356.0880127	100.00
357.0213013	1.06
357.7185669	0.16
360.1606445	0.28
361.4213562	0.45
362.4378967	0.18
373.1603394	0.88
375.2563477	0.20
378.3921814	0.19
383.3898315	0.51
384.2774353	0.21
385.2521057	0.30
386.4506531	0.24
400.2347717	0.90
401.2966614	2.35
403.0067139	0.43
408.7039490	0.32
410.7619629	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	614.9
Annotation	Unknow
Peak:m/z	Relative Intensity
198.9668579	0.08
217.2577362	0.06
228.9039001	0.22
271.4405518	0.02
273.0611267	7.82
274.1390076	0.04
288.8916931	0.02
289.8513184	0.07
371.0112915	0.03
384.9960938	0.02
386.9799805	16.95
387.6831665	0.04
389.0473633	0.01
402.8187256	0.03
441.0870361	0.02
445.0749512	0.05
468.9892578	0.02
470.0426025	0.03
474.1318359	0.02
484.8507080	0.03
498.0698853	0.03
499.1355591	0.68
500.9242554	100.00
501.5905151	0.20
512.9113159	0.11
530.3151855	0.05
531.1901245	0.03
538.2345581	0.01
540.1437378	0.10
541.1194458	0.32
542.5485229	0.09
543.8278198	0.07
548.0869751	0.03
557.0596313	0.06
559.0892944	0.06
567.1636353	0.05
568.1312256	0.52
569.1049805	0.62
570.7316895	0.16
572.1413574	0.07
582.1701050	0.09
583.0704956	0.03
587.0097656	0.06
588.5474854	0.02
596.1541748	0.04
597.0084839	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	556.1783
Annotation	Baumycin C1
Peak:m/z	Relative Intensity
164.0700531	0.12
172.0026093	0.17
180.0039978	0.21
192.1043701	0.48
196.1010437	0.05
202.2126312	0.08
208.2328796	0.14
209.8790283	0.06
219.9834900	0.13
226.0970154	3.67
230.0544891	2.27
238.0805359	12.24
247.0254974	0.21
248.0565186	1.62
256.0874634	8.88
265.1653442	26.18
265.9276123	0.13
274.1415405	58.28
276.9860229	0.13
331.0590210	0.11
343.5184937	0.02
373.6035767	0.03
374.7442017	0.17
375.4963989	0.38
390.9995117	0.14
394.1120605	0.49
397.1016235	0.04
406.0808716	0.30
409.2963867	0.25
427.2242432	0.32
428.4505005	0.10
433.3995361	0.02
448.1749268	0.08
460.5724487	0.08
463.3867798	0.19
472.2624512	20.14
500.0361938	0.06
502.3624878	10.53
520.2611084	10.13
538.2015381	100.00
538.8513184	0.65
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	419.1343
Annotation	Davidioside
Peak:m/z	Relative Intensity
130.1965332	0.02
131.2550812	0.07
134.8249054	0.02
148.1110535	0.03
150.0954590	0.07
151.1443176	0.01
154.3024292	0.01
159.2644501	0.02
161.2171021	0.08
163.2525177	0.02
169.0624084	0.01
171.2116547	0.24
172.2234497	0.07
187.2335968	0.02
191.0876465	0.04
193.1299744	0.01
209.0843506	0.01
211.2716522	0.14
213.1207886	52.08
214.1800995	8.41
221.8407593	0.03
223.0821533	0.02
225.1989746	0.12
227.1514893	0.79
228.2986755	0.04
233.0142822	0.02
237.2331848	0.03
239.2531738	0.11
240.4371033	0.04
241.2524109	0.10
251.1867981	0.06
253.1437073	0.30
255.2095032	1.56
257.1023560	100.00
258.1461792	15.96
259.0049133	0.02
261.3094788	0.01
264.3484192	0.05
265.1359863	0.02
267.2465210	0.84
268.2831421	0.29
269.0873413	0.63
270.2348633	0.09
271.2033997	1.08
272.3210144	0.21
279.2854614	0.04
282.3597717	0.02
283.3232422	0.06
285.2635193	0.14
286.1013794	0.02
291.2595215	0.03
293.4148560	0.01
295.3501587	0.02
297.1822815	0.14
299.1781006	6.26
300.2713013	1.29
309.4643860	0.03
311.2025146	0.04
319.2822876	0.03
321.2541199	0.61
322.2347107	0.08
322.8949585	0.02
329.2086182	1.71
330.1570740	0.44
336.4713135	0.02
341.2944946	0.54
342.2337646	0.13
347.2560425	0.28
348.2709351	0.03
355.2671204	0.01
358.6110840	0.02
362.0270996	0.01
365.4492493	0.08
371.3068848	0.02
373.3416748	0.09
375.4604797	0.02
378.2389221	0.03
383.6618652	0.03
384.3337097	0.03
389.2286072	0.02
401.2681274	0.44
402.2000427	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	787.75
Annotation	Unknow
Peak:m/z	Relative Intensity
230.0613098	1.36
237.0517578	0.04
242.9933472	0.07
244.9603882	0.03
247.0313721	0.84
248.0063782	2.12
265.1292114	12.75
273.1971436	0.23
282.8691406	0.12
290.8593750	0.09
301.2223816	0.22
302.1461182	0.03
313.1404724	0.06
319.2431030	1.42
331.0727539	0.14
376.3028564	0.37
377.2413330	0.21
394.1793823	100.00
657.9386597	0.28
707.1968384	0.02
768.9933472	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	561.2973
Annotation	Unknow
Peak:m/z	Relative Intensity
195.9878693	1.04
213.0807495	12.06
216.8472137	0.07
306.3055115	0.06
387.0563965	100.00
387.7677002	0.34
390.3777466	0.10
391.2195435	0.10
392.6735229	0.28
405.1463013	0.09
424.8118286	0.08
476.7298584	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	787.1936
Annotation	Myricetin 3-rutinoside-7-glucoside
Peak:m/z	Relative Intensity
300.9873352	0.06
302.2043152	0.02
343.4273376	0.02
463.2598267	8.40
464.3530273	0.22
505.5073242	0.02
527.0484009	0.04
625.2680054	100.00
626.2053833	1.93
650.4948120	0.01
676.9640503	0.02
699.4410400	0.01
743.6176147	0.01
752.3895874	0.03
769.0173950	0.01
778.1853638	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	549.1671
Annotation	Unknow
Peak:m/z	Relative Intensity
377.3372803	0.11
484.3139038	0.04
503.3471680	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	324.21
Annotation	Lysergic acid diethylamide
Peak:m/z	Relative Intensity
110.8873672	0.05
112.0407410	0.02
114.9488678	0.02
119.9662399	0.03
120.9891129	0.10
124.6448517	0.04
132.0463257	0.33
133.2239380	0.06
138.1253967	0.07
148.5914612	0.08
149.2539368	0.01
151.0646362	0.07
161.6553650	0.07
164.8097839	0.05
167.0973206	0.01
174.9482880	0.15
177.2954102	0.02
184.1666870	0.37
193.2663116	0.32
194.0250549	0.18
195.0824890	0.08
196.3077087	0.03
198.2491455	0.06
202.9697723	0.01
205.3381042	0.06
207.1291199	0.06
212.1282043	2.92
219.0566711	0.03
225.2587891	0.08
232.8272400	0.04
233.8346863	0.23
238.1809387	0.03
239.1810608	0.08
240.1029663	0.03
246.6681519	0.02
252.1481934	0.17
253.2864380	0.03
260.1241455	0.02
263.9894714	0.02
265.7661743	0.05
268.1458740	100.00
268.8920288	0.23
269.5505676	0.18
279.2726440	0.07
280.1477356	0.09
287.9770508	0.09
296.1411133	0.06
302.5908813	0.06
305.1805420	0.03
306.1974487	0.46
308.2763367	0.37
308.9363403	0.08
315.1399536	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	461.2914
Annotation	Unknow
Peak:m/z	Relative Intensity
183.1693115	0.25
315.2416382	100.00
315.9288940	0.38
360.1685181	0.62
382.7778015	0.30
399.1343689	1.08
405.9788513	0.20
415.7008362	0.25
443.3386841	1.56
444.4674683	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	661.1176
Annotation	Myricetin 3-neohesperidoside
Peak:m/z	Relative Intensity
241.9475403	0.04
299.1148071	0.03
337.5667114	0.04
381.1520996	0.09
463.2796021	4.91
492.6093750	0.05
572.3795776	0.13
589.3413086	0.04
625.2034302	100.00
625.9323120	0.19
631.8031006	0.13
640.2606812	0.09
641.2704468	0.16
642.4839478	0.35
649.2569580	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	632.88
Annotation	Unknow
Peak:m/z	Relative Intensity
198.9768219	0.05
215.0608215	0.21
272.9636230	1.45
274.0066528	0.75
275.2444153	1.06
289.0491333	6.14
290.0062561	1.56
290.9985657	0.81
372.4628906	0.03
387.1065674	1.64
388.0848999	2.19
389.0560913	1.88
402.9863281	17.47
404.0234375	14.71
405.0540161	12.81
459.0807495	0.05
501.9949341	0.31
503.0715942	0.26
516.9639282	49.27
517.9736938	99.96
519.0196533	100.00
543.3625488	0.15
544.1003418	0.04
549.0958862	0.04
557.9863281	0.07
559.2370605	0.18
577.4370728	0.03
586.0632935	0.64
587.0642700	0.13
588.9855347	1.02
605.0046997	0.28
615.0530396	0.07
622.3007812	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	287.1595
Annotation	Unknow
Peak:m/z	Relative Intensity
90.9580994	0.41
92.9626007	0.20
95.0325394	1.71
96.9223099	0.11
100.9889221	0.27
109.3287201	0.34
111.9721603	19.31
112.9398727	0.84
119.9676971	0.04
123.2240448	0.26
128.8736115	0.05
130.0870209	1.34
132.9550781	0.09
134.0971069	0.14
135.2217712	0.04
140.1213684	0.35
144.0371399	0.12
145.0989685	0.07
148.0961609	0.59
152.9576721	0.08
154.8827362	0.11
158.0125580	100.00
158.9214783	0.51
161.0101013	0.13
162.0259705	0.65
163.1143494	0.21
165.3486023	0.12
165.9586182	0.16
167.0508118	0.21
169.0418243	0.35
171.1235962	0.11
172.9217529	0.53
174.8841400	0.44
178.0865479	0.18
179.1959229	0.20
181.1187897	0.12
183.0265503	0.27
183.8044739	0.10
185.1235199	0.54
189.1085205	0.15
191.1303558	0.16
194.0542297	0.07
196.2050171	0.22
199.3945312	0.08
205.6405640	0.48
210.1875916	0.13
211.0493164	0.19
213.1853638	0.06
216.1495972	0.10
217.2089233	0.31
222.9440918	0.31
224.0753479	3.40
225.0874023	0.70
227.1654968	0.20
229.0857849	0.34
231.0290833	0.11
238.0700378	0.10
240.9855347	0.88
241.9018860	0.16
243.1895447	0.48
244.0700378	0.15
245.9923096	1.21
251.1579895	0.68
254.0362244	0.18
254.8316650	0.12
258.1496887	0.13
259.2211304	0.06
264.9479065	0.10
266.5697021	0.09
269.1035461	9.96
270.2739258	18.73
272.8150024	0.48
273.5732422	0.26
278.0817261	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	357.249
Annotation	Unknow
Peak:m/z	Relative Intensity
108.1383591	0.19
110.0458069	0.33
116.2173920	0.10
124.0216217	2.62
129.1091614	1.83
139.0811768	0.20
142.0612335	7.36
143.1537018	0.18
151.9387207	5.74
155.1808472	0.17
156.0071411	0.09
157.0607605	0.13
161.1401672	0.18
169.4914551	0.85
170.1096802	2.83
173.3873749	0.27
179.0103302	0.19
196.1690674	0.20
197.0683289	0.78
207.0670624	0.19
209.2485046	0.26
215.1941528	1.80
224.2439880	0.68
226.0769348	1.18
226.6852417	0.08
229.1480103	100.00
235.1573486	0.26
240.1557007	0.78
242.1839294	1.99
250.0353088	0.12
251.0101624	0.41
251.9454041	0.05
252.5493164	0.26
258.1880798	7.55
260.2681274	0.22
262.2445068	0.32
268.2284546	0.07
270.2939453	0.70
272.3095093	0.51
272.9242554	0.48
276.3544922	0.19
280.1815186	4.32
281.2774048	0.72
282.4538269	0.28
294.3508301	0.05
298.2436523	36.35
298.8728638	0.10
312.4192505	0.44
313.2681274	0.05
339.4637451	2.26
340.3803711	0.74
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	476.06
Annotation	Unknow
Peak:m/z	Relative Intensity
174.9786835	0.09
187.2973022	0.16
193.4686584	0.16
200.8271179	0.20
211.1920776	0.11
239.2632751	0.15
246.2184448	0.14
247.1372070	0.12
248.1138000	0.25
253.0893555	0.38
261.2368774	0.19
267.9664612	0.19
275.2902222	0.31
285.0657043	0.23
287.0768433	0.37
288.9927063	0.24
297.1866150	0.14
312.6109009	0.42
313.4549561	0.23
317.2283325	0.13
318.3499756	0.23
323.3103027	0.51
342.4884033	0.16
344.6441040	0.46
345.7298584	0.18
346.3356934	0.18
347.1207886	1.13
348.0248718	0.50
350.1802979	0.47
355.0946045	0.04
364.2186890	0.23
369.2732239	0.20
371.0427246	0.10
373.3458862	0.05
383.2948608	0.08
385.0758362	0.06
390.2280273	0.18
397.0038757	1.59
403.3132935	0.15
404.1504822	0.23
413.0792236	100.00
414.2184143	0.77
415.3741760	0.06
421.4690247	0.20
427.5232239	0.11
430.3008728	0.22
439.5096436	0.36
440.3398438	0.50
441.4177551	0.37
447.2775574	1.72
457.2584229	0.43
458.2205505	0.76
459.3068542	15.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	293.1145
Annotation	L-gamma-Glutamyl-beta-phenyl-beta-L-alanine
Peak:m/z	Relative Intensity
127.9441223	100.00
147.2261047	0.08
164.0448761	3.51
257.1965332	7.77
275.1564941	92.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	566.1572
Annotation	Unknow
Peak:m/z	Relative Intensity
223.8392334	0.57
239.4309998	0.54
324.4581299	0.84
341.1343994	2.36
342.1464844	0.45
385.3193970	0.48
404.2988281	4.46
405.1102295	1.29
503.2714233	100.00
504.3672485	19.59
531.2642212	0.81
546.1299438	2.82
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	611.1448
Annotation	Oxidized glutathione
Peak:m/z	Relative Intensity
171.1787109	0.18
177.0235748	0.43
178.9533844	2.98
184.9152679	0.20
192.0550842	0.28
197.1755981	0.13
209.0964966	0.18
210.1408691	2.61
211.2500153	0.19
226.1310272	0.23
228.2000122	0.09
228.8281555	0.13
236.1307220	0.06
237.2533722	0.08
242.1365814	0.24
252.1738892	0.27
254.1157990	10.58
272.1994019	34.83
284.6398315	0.06
286.1408691	0.75
288.2399902	6.43
304.1981201	11.92
306.2122192	100.00
311.3032227	0.11
319.8591309	0.18
338.1719360	42.45
353.3482666	0.06
389.0142822	0.05
427.4719849	0.09
429.1141968	0.07
430.3264160	0.05
463.6782837	0.11
464.2849731	1.32
465.0043335	0.22
478.1115112	0.11
482.2281494	29.87
499.4918823	0.04
504.1934814	1.02
505.3764038	0.21
527.4100952	0.09
538.8058472	0.12
560.4386597	0.44
575.2538452	0.73
593.3035278	18.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	261.1436
Annotation	Leucyl-Glutamate
Peak:m/z	Relative Intensity
75.2063065	0.03
84.0024719	0.08
85.9297790	20.66
129.9464111	1.06
131.9901733	100.00
147.9777374	0.70
198.1343842	5.03
215.1251984	1.93
225.1435242	0.61
243.1025543	7.09
244.2419586	32.71
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	460.0866
Annotation	Unknow
Peak:m/z	Relative Intensity
143.1510162	0.86
158.2036438	0.36
174.8569946	0.92
176.9815063	1.49
206.4070129	0.81
209.1985626	2.00
211.1647797	0.82
217.8166504	0.52
224.9010925	4.23
233.8814240	1.07
245.2002258	1.58
251.0924377	1.77
306.0578003	1.02
309.4979553	0.50
329.8493652	0.60
331.0922852	100.00
340.3097534	0.94
347.1640625	2.41
371.1428223	6.36
385.0751648	9.52
390.1579895	0.39
391.2829590	0.26
419.0812378	1.06
422.1365356	0.41
422.8473206	1.32
441.5109253	0.29
442.3453979	0.26
521.8693237	0.58
697.6078491	0.89
763.6450195	0.50
790.7124023	0.67
801.9857788	1.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1222.3995
Annotation	Unknow
Peak:m/z	Relative Intensity
394.2222290	100.00
556.2939453	1.38
676.4825439	0.32
879.7340088	1.06
880.3973389	0.96
898.5001221	2.28
908.9989014	0.40
1041.8959960	2.18
1042.5410160	2.15
1054.8510740	0.62
1060.2497560	22.34
1090.7360840	0.37
1091.5201420	1.75
1222.5142820	1.91
1223.2406010	2.93
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	638.3379
Annotation	Unknow
Peak:m/z	Relative Intensity
235.5929108	0.32
302.1077881	0.12
328.1438599	0.43
346.0581055	6.05
347.1552124	0.13
456.2786865	0.21
461.3809814	0.31
474.3510132	3.51
476.4016724	0.37
491.6925049	13.08
492.3165894	100.00
574.1136475	0.53
614.9896851	0.37
621.3040771	1.75
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	425.14
Annotation	Unknow
Peak:m/z	Relative Intensity
191.0419159	0.47
196.1708374	0.18
208.8974457	0.03
212.8674316	7.45
232.0425415	1.33
251.1289978	100.00
292.6808167	0.15
318.2146606	0.09
365.3104553	0.19
383.1521912	0.20
408.0150452	0.19
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
83.9862976	0.18
86.0110016	17.77
111.8408051	0.03
129.9948883	0.41
132.0173492	100.00
148.0258636	0.80
198.1451263	6.08
214.1602631	0.18
215.1276093	1.59
225.1740112	0.73
243.1060944	7.76
244.1379852	34.58
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	213.0745
Annotation	Methyl syringate
Peak:m/z	Relative Intensity
154.0453949	0.27
171.0945587	0.04
178.1610870	0.07
195.1880951	24.58
196.0101013	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	503.19
Annotation	Limonexic acid
Peak:m/z	Relative Intensity
149.0141602	0.09
163.2232971	0.15
174.9721069	1.55
211.1371460	0.13
217.1415710	0.73
219.0677490	0.14
229.2682190	0.52
251.0756226	0.22
278.8249207	0.17
283.0574341	0.11
284.2129211	0.12
291.1785278	0.20
300.8973389	0.31
307.0631104	0.47
309.5143127	1.15
311.0416870	1.79
323.2493286	6.73
325.2710876	1.41
341.4184875	1.82
344.1058960	0.62
353.4516296	0.09
369.2279968	0.11
373.1069031	1.44
373.8733521	1.95
379.3997803	0.18
391.9550476	0.82
395.0954895	0.37
413.0968323	21.72
414.1121216	100.00
414.7576294	0.32
425.2680359	0.73
431.4438782	0.17
438.8870850	0.15
441.1707153	0.08
443.3925476	0.46
445.4117126	0.29
467.5375366	0.29
471.0358582	0.09
475.3314819	0.21
485.2620239	2.73
486.4269409	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	444.0914
Annotation	Unknow
Peak:m/z	Relative Intensity
205.2187805	0.34
209.1644287	0.36
216.3749847	0.18
218.9174194	0.15
225.1738586	0.17
233.3981476	0.19
242.9802551	2.94
251.2061768	0.16
261.0821533	0.12
283.0759277	25.55
299.3421326	0.40
311.0563965	0.14
314.9591675	6.95
321.2596741	0.17
338.1412354	1.40
339.0508423	0.11
348.2959290	0.62
350.4612122	0.14
369.0925903	1.52
370.0175476	0.26
372.1872864	40.76
380.2360535	0.50
394.1551208	0.37
412.1257629	100.00
420.8925476	0.39
425.1897278	0.89
426.1273804	0.16
427.2096863	0.63
439.5570374	0.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	580.0409
Annotation	Unknow
Peak:m/z	Relative Intensity
169.1520844	0.28
175.0800476	0.10
179.0341339	0.34
185.0999146	0.17
191.7958374	0.10
203.0887756	0.81
205.9620972	0.08
211.0660095	0.40
213.2232361	0.13
214.9466553	0.11
221.8632202	0.13
226.1337433	0.15
249.1177368	1.79
250.1980896	0.16
252.0546265	0.10
254.2129211	1.04
260.3268433	0.63
261.0473022	0.04
272.1932373	7.13
273.0878296	0.42
286.1571045	0.56
287.5876465	0.36
288.2526245	0.36
289.2315674	0.23
290.2207031	0.09
291.0422058	0.05
293.1580200	0.09
304.1918640	2.57
305.0796509	0.38
306.1341553	3.47
307.3332520	0.49
312.9936829	0.25
321.1049805	0.20
322.5962524	0.16
326.0642700	0.17
333.3289185	0.10
334.2642212	0.12
336.2966309	0.04
337.1755371	0.14
338.0035400	0.06
341.2191772	0.13
344.1403198	0.10
346.3252563	0.76
347.2281494	0.26
348.0978394	0.10
357.3389282	0.14
360.0709229	2.40
361.3192749	0.41
378.2011108	100.00
379.2686157	14.82
385.1975708	0.20
388.5518799	0.25
392.8167725	0.11
395.0186157	0.08
403.3092041	0.07
409.1697998	0.06
411.0559692	51.75
412.1739502	10.29
413.3262939	0.09
420.4621582	0.37
426.2358398	0.19
443.0894165	25.23
444.0875854	5.44
445.2183228	0.09
450.0300293	3.83
451.3182983	0.86
452.9744263	0.05
466.2887573	0.08
479.3492432	0.13
484.0321655	1.36
487.7327271	0.04
490.5029297	0.03
497.2427979	0.12
498.0858765	0.23
498.9199829	0.10
504.1369629	0.03
506.3267822	0.08
508.1188354	0.40
516.0285645	4.93
516.8942871	0.64
517.5084839	0.24
524.0741577	0.16
535.3854370	0.39
536.7921753	1.56
537.4719849	0.04
540.2005005	0.11
543.9199829	0.64
545.4926758	0.17
553.2445679	0.11
557.8072510	0.12
562.4121704	0.31
563.3623657	0.45
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	716.84
Annotation	Unknow
Peak:m/z	Relative Intensity
206.9874268	0.50
211.6489716	0.76
336.9628296	0.89
374.2726440	0.44
418.8942871	1.22
460.2431030	0.30
462.2377319	0.53
462.9283447	1.33
465.0054321	0.81
516.5540771	0.61
542.2980347	0.57
546.8881226	1.61
548.2999878	3.18
549.2666016	0.53
586.7484131	7.71
588.2955933	0.53
631.9265747	6.71
632.5943604	46.74
633.2626343	0.82
670.6056519	100.00
693.2827148	1.59
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	412.1194
Annotation	Unknow
Peak:m/z	Relative Intensity
130.2245483	0.07
147.0973663	0.12
167.3183594	0.05
170.1326294	0.06
175.8054199	0.04
179.9721069	0.09
188.0902710	0.11
210.9532928	2.04
214.8982391	0.06
216.0621948	0.15
219.2801361	0.10
221.2053528	0.12
233.0687561	0.16
234.0717773	0.08
237.1721802	0.14
247.0935364	0.08
251.0856323	23.20
253.4663391	0.09
265.1357727	0.28
271.4507446	0.07
274.3730774	0.13
279.8919678	0.06
282.6027222	2.69
283.2328186	3.15
305.1068726	0.64
305.7817993	0.38
333.3020325	0.07
336.9825439	0.75
339.0680237	0.04
340.2022705	21.83
348.4147949	0.12
351.2948608	0.11
357.8460083	0.07
362.0798950	0.19
364.2939148	0.10
370.4819031	0.06
375.9733887	0.08
380.1172180	100.00
380.7809143	0.22
393.5327759	0.04
394.4140930	0.34
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	638.59
Annotation	Unknow
Peak:m/z	Relative Intensity
187.2684021	0.33
283.0210571	0.92
308.4617004	39.14
312.5943604	1.38
323.6817017	0.46
356.4248657	8.20
365.1866455	0.93
537.0931396	1.88
543.6177979	0.46
620.7789917	100.00
621.4257202	0.44
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	149.05
Annotation	D-Apiose
Peak:m/z	Relative Intensity
56.9160385	0.07
58.9418564	2.32
71.0979767	0.06
72.9669876	2.40
74.9075775	0.60
86.8834381	0.08
88.9826050	32.51
101.1479340	0.10
102.9781189	16.40
130.9116974	100.00
131.7047272	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	701.191
Annotation	Citbismine C
Peak:m/z	Relative Intensity
221.0621033	0.03
233.3730774	0.01
251.2271729	0.02
275.0294495	0.02
281.1388550	0.02
322.9572754	0.09
340.8501587	0.37
341.4614868	0.30
359.2954102	0.07
377.0832520	0.24
383.1649170	0.27
395.7000122	0.02
411.7911987	0.02
443.1751709	0.16
485.3067627	1.28
503.3177490	0.37
521.2025146	0.16
538.7933960	0.02
539.4408569	0.47
545.2077026	0.29
575.1850586	0.06
604.9385376	0.03
629.6549072	0.02
647.3049927	0.02
665.3441772	100.00
666.1704712	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	683.2658
Annotation	Unknow
Peak:m/z	Relative Intensity
284.1588745	0.07
298.1121826	0.13
300.1670532	0.03
342.3175049	0.08
353.2484741	29.66
354.3080444	6.45
397.0310059	0.04
480.6424561	0.10
481.3110962	0.11
483.1359253	0.10
518.1918335	100.00
519.2979126	24.51
555.2377319	0.06
621.1945190	0.04
637.5252075	0.08
638.5485840	0.11
665.7803955	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	216.97
Annotation	Fosfomycin monophosphate
Peak:m/z	Relative Intensity
79.8068161	31.27
80.8194046	7.50
82.8392792	0.06
95.0088043	0.07
96.9320984	0.13
105.0529785	0.10
108.9704285	0.21
113.1274261	0.17
114.9989319	0.12
120.9247437	0.07
121.9735870	0.08
131.3332367	0.11
132.3249664	0.10
134.2685242	0.22
137.0893860	0.40
142.9974365	0.22
143.9132385	6.72
144.8704224	100.00
146.7290497	0.24
152.9563751	18.46
153.9677582	0.06
155.2122498	0.65
156.0414886	0.04
157.0254669	0.40
158.1976929	0.17
161.0572510	0.13
168.2545776	0.12
170.8428497	0.10
172.0644379	0.48
172.9635773	2.22
177.0705109	0.11
178.9978027	0.63
180.0987396	0.07
180.9854431	0.31
182.9550018	0.06
186.8795624	0.10
188.0309296	0.34
188.8550110	0.50
197.0292664	0.28
198.2235260	0.33
199.0322723	1.55
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
160.8957214	0.12
179.0539246	1.34
221.2298889	0.68
250.1598663	0.07
251.0588837	0.29
263.0509949	0.08
280.9247437	0.28
293.2761230	0.05
305.4804077	0.02
311.1901245	0.08
317.3251953	0.08
323.2052612	0.34
341.2008057	1.80
359.0025024	0.17
377.1869507	7.12
377.8576050	0.02
503.2971802	100.00
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
71.9544830	0.29
72.8423462	0.04
73.9357300	1.33
85.9200974	0.06
115.9763947	30.32
118.1446686	0.04
128.0458069	0.49
129.0511627	0.21
130.1526947	0.98
130.9986877	0.19
132.1556396	0.39
139.1697540	0.05
142.0875397	14.56
144.0753326	0.03
157.0798645	0.17
159.0417328	100.00
167.0843964	0.09
172.9951019	1.87
174.3472595	0.09
176.1778107	0.08
185.5416870	1.19
186.1510468	9.73
203.4482269	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	543.1302
Annotation	Galactotriose
Peak:m/z	Relative Intensity
192.3812256	0.11
215.0456543	0.33
216.2377930	0.19
219.3056641	0.34
230.9839783	0.17
238.1513214	0.06
240.2015228	0.09
251.2177887	0.20
260.9939880	0.14
265.4338379	0.17
274.1661987	0.39
291.0238037	0.17
306.8171387	0.28
320.3869629	0.09
334.0491943	0.20
344.6059570	0.24
351.1636963	0.46
355.5250244	0.15
358.6088867	0.07
361.3671265	0.14
363.1996460	20.33
366.3908691	0.07
367.1858521	0.09
371.1862793	0.28
377.8901367	0.11
381.1316528	100.00
385.4959106	0.39
408.3704834	0.10
409.3675537	0.31
411.2828369	0.09
413.1837769	0.31
414.1277466	0.23
428.4327393	0.20
452.0901489	1.07
453.3815918	0.84
458.0644531	0.05
467.4630737	0.05
489.3106079	0.06
498.8027344	0.57
507.3227539	0.10
510.4196167	0.30
523.2453003	0.76
524.1392212	0.58
525.3646851	0.33
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	287.1613
Annotation	Unknow
Peak:m/z	Relative Intensity
98.7863159	0.24
110.9333344	0.09
115.1139832	0.34
127.9649811	100.00
132.2338257	0.15
134.0236206	0.10
149.3053894	0.31
156.2129974	0.08
158.1188660	2.82
171.1785583	0.09
173.3112488	0.07
187.1111450	0.07
189.2458191	0.05
197.1092224	0.12
208.5277405	0.20
209.1888733	0.28
211.0106201	0.08
213.1654358	0.11
225.1231079	0.26
226.9595337	0.35
227.9522095	0.07
240.9552307	0.49
243.2812500	1.25
250.5433350	0.37
251.2577820	4.25
252.0771484	0.18
253.3104858	0.13
259.0347290	0.12
267.1196289	0.07
269.1932983	67.61
270.1386719	0.08
286.9595337	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	391.1286
Annotation	SN-38
Peak:m/z	Relative Intensity
104.9929657	0.04
130.7774506	0.04
145.0685577	0.17
146.0971375	0.03
146.8787384	0.02
153.2073975	0.01
155.2266541	0.05
159.0501099	0.03
161.0966949	0.03
169.9073029	0.01
170.9530945	0.01
175.0163879	0.24
175.8474731	0.02
177.0786438	0.04
182.3430481	0.01
197.0704346	0.04
199.0988922	0.14
201.0273743	1.91
204.3729858	0.01
216.8669128	0.02
218.9986572	0.02
223.0000305	0.02
239.1362915	0.02
241.2148132	0.02
243.2434082	0.05
245.1086426	9.67
246.0051270	0.04
247.0375366	0.09
249.1234131	0.04
257.5974426	0.01
258.2908630	0.02
259.2322693	0.01
261.3446655	0.01
262.9027710	0.06
271.4683838	0.02
275.2405396	0.21
276.2453308	0.01
285.5545349	0.01
287.1351929	0.03
301.4218750	0.01
303.3700562	0.05
304.2860413	0.09
307.4873047	0.03
326.4688416	0.03
328.2928467	0.01
330.5718689	0.05
343.1821289	0.04
345.2171021	100.00
346.3115234	0.90
347.2368774	21.12
356.0712280	0.06
359.8742981	0.08
362.0268860	0.38
363.0642090	1.41
367.5863037	0.02
371.2104492	0.09
372.4767151	0.46
373.4107666	0.14
390.9844666	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1025.2938
Annotation	Unknow
Peak:m/z	Relative Intensity
341.1304016	0.03
485.0387573	0.08
502.7544250	0.02
503.3615723	0.10
545.4957275	0.12
575.0869141	0.02
647.2324829	0.08
665.2452393	0.23
683.4969482	0.01
701.4640503	0.14
707.5013428	0.05
809.7462158	0.05
826.9012451	0.17
827.6394043	0.03
863.1717529	0.03
869.5078125	0.15
987.6076660	0.01
989.4764404	100.00
990.4763184	1.81
991.0897217	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	621.31
Annotation	Unknow
Peak:m/z	Relative Intensity
175.1527252	6.16
212.9867706	3.45
311.1741333	1.23
349.2556763	20.42
388.9750366	0.35
408.4536743	1.58
409.1200562	7.07
425.0563354	4.71
446.4812012	8.15
447.1279907	100.00
484.4918823	3.48
485.1516724	13.56
522.9014282	7.14
536.8431396	1.08
557.6467896	0.45
601.8189087	1.41
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	636.2687
Annotation	GW 6471
Peak:m/z	Relative Intensity
192.5315857	0.14
195.2338104	0.23
205.0591431	0.61
211.1244507	0.75
217.0684814	2.46
223.0861053	5.25
228.6981506	0.51
233.5140991	0.56
241.0877075	2.72
246.9590759	0.96
253.0668945	3.76
256.7620850	0.12
258.8267822	5.98
271.1614380	8.68
276.7140503	2.70
288.8431091	29.07
294.2135620	2.47
306.8872681	8.54
309.4771118	0.50
312.0967407	1.60
325.0644531	100.00
326.4878540	0.49
340.9268799	0.35
342.9027100	23.79
415.2626343	0.30
451.6668091	0.59
453.4093018	0.32
456.0834351	16.14
474.1300049	46.62
485.6389160	2.03
486.9595337	9.25
502.1526489	0.30
504.4031372	3.31
505.3600464	0.64
506.5393677	0.22
618.0529175	3.54
618.7645264	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	321.11
Annotation	Antibiotic CJ 12371
Peak:m/z	Relative Intensity
102.2083664	1.88
108.8927078	0.40
112.4479980	1.06
130.0601807	8.19
145.7532043	0.69
148.0291443	100.00
148.7732544	0.73
162.0744171	2.15
168.9179688	0.78
177.0678558	0.87
191.1363373	7.39
228.1028442	1.49
240.2222900	0.89
245.0664368	1.12
247.0645752	3.11
257.2695312	0.97
260.3296814	2.19
263.9325562	1.63
265.4150391	1.21
275.2662964	8.26
279.9102783	3.82
289.5745850	1.24
298.3849792	3.22
303.2225342	6.61
312.4492798	4.24
320.4568787	0.54
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	379.08
Annotation	Lisetinone
Peak:m/z	Relative Intensity
114.0718384	0.12
131.2162476	0.03
142.9312897	0.15
144.2857666	0.02
161.0936890	0.27
161.9840088	0.12
179.0235138	1.55
179.6528168	0.02
196.9871063	0.03
198.1443481	0.11
198.9685669	0.32
215.0215454	2.07
216.1296082	2.20
217.0564575	6.99
221.1320496	0.05
251.5991211	0.06
323.3005981	0.04
341.2002258	100.00
342.1738586	32.80
343.2673035	7.83
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	728.21
Annotation	Unknow
Peak:m/z	Relative Intensity
220.9319763	0.70
223.0768127	0.39
224.1197510	0.14
244.8764343	0.09
251.0049133	0.07
305.3092041	0.05
323.3089600	0.22
340.0920410	0.10
365.7257080	0.03
367.2691040	0.22
383.2691650	0.43
385.3156128	2.07
386.3019409	0.31
404.0669556	0.24
443.1954346	0.20
484.9183960	0.15
485.5194702	0.65
503.2214355	0.47
518.2360229	0.04
523.5187378	0.11
545.3474121	0.47
547.3168335	1.53
548.4058838	0.23
566.4379272	1.09
567.4263306	0.19
612.7091675	0.14
665.3416138	100.00
666.0067139	0.22
689.8245239	0.13
707.3770752	1.36
710.1942139	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	735.18
Annotation	Unknow
Peak:m/z	Relative Intensity
213.0016022	0.38
224.5714111	0.11
251.2984924	0.15
349.2864380	0.11
387.0237427	5.78
404.3281250	0.18
425.3583984	0.05
465.5120850	0.18
560.4503784	7.85
561.0927734	100.00
562.1289062	0.11
563.2064209	0.27
564.6547241	0.48
566.9340210	0.55
621.2827759	0.08
637.0320435	0.67
647.9370117	15.46
648.6844482	0.10
650.7922363	0.59
661.5760498	1.26
663.2908325	0.20
668.5073853	0.99
711.4107666	0.13
717.2740479	0.13
718.0350952	0.22
734.7792358	0.35
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	754.3207
Annotation	Unknow
Peak:m/z	Relative Intensity
224.4319458	0.79
406.0867310	2.13
425.1348877	22.46
580.2014160	17.20
583.6818848	0.91
584.5620117	2.82
599.1405640	100.00
621.2898560	2.52
670.3582153	2.27
707.8070679	1.75
711.8568115	2.96
729.9280396	1.43
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	293.1142
Annotation	L-gamma-Glutamyl-beta-phenyl-beta-L-alanine
Peak:m/z	Relative Intensity
99.8057632	0.49
101.0233154	0.12
107.2252350	0.13
109.1412354	0.43
111.0507965	0.11
112.9558716	0.05
128.0696411	100.00
129.2904358	0.08
129.9537659	0.38
134.0929260	0.08
140.9252625	0.28
143.0848389	0.08
144.0426025	0.72
148.1473694	0.19
154.1678619	0.05
162.0261230	0.05
164.0419617	3.52
167.2176666	0.04
171.0717773	0.17
172.5747070	0.21
177.1414185	0.06
178.9215546	0.15
187.0460205	0.06
189.1766205	0.05
196.3100281	0.07
203.1578979	0.36
205.2133179	0.12
215.1620178	0.24
216.0771179	0.04
217.2508850	0.12
223.2461853	0.09
231.1545105	0.30
232.0480652	0.04
233.0889282	0.20
245.2525940	0.14
247.1369019	1.51
249.0798035	1.63
250.1402283	0.13
257.1559448	8.37
273.0115356	0.21
275.1762695	89.80
293.8083801	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	324.29
Annotation	Anandamide (18:2, n-6)
Peak:m/z	Relative Intensity
121.2178650	0.14
128.9654541	0.05
135.2936554	0.06
150.0187988	0.53
151.1549988	0.34
155.9478149	0.10
156.6875610	0.09
165.3332214	0.06
184.6668701	0.25
187.2877197	0.24
189.3107605	0.12
193.0676727	0.11
197.2220917	0.42
207.2211304	0.19
209.0659180	0.09
212.1470947	3.79
212.9446106	0.09
218.0753784	0.14
227.2542725	0.43
239.2916260	0.19
245.7895508	0.19
247.3396606	0.33
252.5031128	0.09
263.2346802	0.38
266.3095398	0.12
268.1843262	100.00
269.3056030	5.27
271.2384033	0.19
271.9025879	0.12
277.1879883	0.14
278.0056763	0.41
283.4371948	0.23
288.3735657	0.33
289.3425903	2.89
294.5781250	0.28
303.1257935	0.78
306.3136292	3.38
307.2420654	0.56
309.5661011	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	293.1
Annotation	N,N'-Ethylenediaminedisuccinic acid
Peak:m/z	Relative Intensity
83.9128494	1.37
95.8952484	0.11
98.9974289	0.16
101.0453491	0.11
101.7264862	0.11
106.6659393	0.16
111.2295532	0.32
116.0406342	0.70
116.8943481	0.08
118.0159836	2.59
118.8561478	0.13
122.0000763	0.89
123.9750519	5.31
125.1575470	0.18
126.0688858	0.06
128.2518768	0.10
130.0451050	0.41
130.9464874	0.07
141.9314270	1.15
143.4663544	0.17
144.9891357	4.41
146.2595520	4.43
147.0481110	33.95
148.1290741	0.05
149.0751190	0.20
161.9675293	18.45
163.0739441	13.37
164.0486908	100.00
169.9652100	65.83
171.0652466	7.71
172.1368103	14.06
173.9442902	0.22
187.9363251	0.37
188.9739990	0.13
212.0172119	0.36
217.2840576	0.36
219.1109619	0.06
228.2936707	0.13
229.3159180	0.16
230.1113281	0.94
231.1997375	0.27
232.7425842	0.53
236.0476379	4.24
245.0822754	0.69
246.4963989	0.80
247.2111511	4.12
251.8405151	0.23
257.2749023	0.04
261.1675720	0.30
265.3308105	0.23
273.1379395	0.10
275.1201782	10.63
276.1865234	5.73
284.5835876	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	243.05
Annotation	3-Hydroxy-3-carboxymethyl-adipic acid
Peak:m/z	Relative Intensity
113.0515442	2.96
132.0825195	1.10
133.0482788	0.39
146.9078674	2.51
152.9291229	100.00
178.8792725	0.89
183.2041779	1.64
195.9952850	1.76
201.7971649	0.53
222.5940857	2.28
225.2115479	13.73
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	867.2339
Annotation	Unknow
Peak:m/z	Relative Intensity
255.6608582	0.05
355.4461670	0.26
363.0960388	1.78
381.2977905	2.87
422.9959106	0.09
483.0488281	0.09
517.7064819	0.16
524.3607788	0.65
525.2397461	14.44
543.3359375	26.60
624.7706299	0.08
645.4100952	0.05
687.4519653	9.36
695.5958862	0.69
705.3135376	100.00
706.0005493	0.07
722.3602905	0.20
723.3284302	0.20
724.4096680	0.15
777.3739624	0.20
866.6676636	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	858.2305
Annotation	Unknow
Peak:m/z	Relative Intensity
354.2667236	0.27
381.1647949	0.25
525.6331177	2.94
543.4104614	0.91
605.9878540	0.61
687.4885864	1.48
688.4767456	0.32
689.4425659	0.38
705.3490601	3.89
706.2940063	0.54
777.5731812	4.21
791.9086914	0.16
849.6870728	2.08
850.6281128	0.41
1011.5071410	2.51
1012.4841310	0.34
1029.5686040	6.20
1030.5083010	1.02
1031.5930180	0.75
1173.6166990	0.84
1191.5762940	2.01
1335.6998290	0.75
1353.5933840	2.19
1383.0966800	0.29
1457.5989990	0.77
1502.3792720	0.38
1511.2010500	0.16
1515.6988530	1.91
1516.5262450	2.41
1528.8631590	0.09
1570.9056400	0.53
1594.1466060	0.15
1605.2689210	0.12
1612.0985110	0.21
1613.0535890	0.16
1632.3757320	0.58
1649.2406010	0.60
1651.7506100	0.81
1657.3933110	0.18
1677.7502440	100.00
1678.7269290	54.00
1679.8332520	7.49
1695.6234130	0.12
1699.7629390	0.42
1703.8614500	1.13
1709.7282710	0.65
1710.4616700	0.09
1711.4083250	0.09
1721.1451420	0.72
1723.8443600	0.15
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
109.9799652	0.22
127.9491653	73.09
129.0075836	35.35
164.0478668	3.63
165.0899658	1.40
190.9753418	0.18
203.2405701	0.44
248.0609131	0.14
250.1719360	0.42
257.2532654	0.27
258.1554565	8.79
275.2224731	13.19
276.1879272	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	307.151
Annotation	1-[(5-Amino-5-carboxypentyl)amino]-1-deoxyfructose
Peak:m/z	Relative Intensity
96.5061874	0.03
100.9659500	5.93
113.0827179	0.30
126.0767136	0.33
131.0180969	0.33
142.9183350	0.38
143.9734497	2.11
145.0853271	33.16
152.8163452	0.07
155.3563232	0.03
157.2412415	0.11
159.2922363	0.08
160.3814392	0.21
161.0394287	2.77
173.3256531	0.07
175.0085907	0.10
181.2302094	0.11
183.8279114	0.06
185.0678711	0.17
187.0662537	56.96
187.6701660	0.07
198.9941711	0.05
203.0808411	0.43
209.1397705	0.10
211.3015137	0.11
214.9442444	0.10
217.1207275	100.00
219.2451172	0.06
221.1092224	0.04
227.3284302	0.07
229.1876221	4.85
235.2245789	0.10
241.2183533	1.21
244.9939880	0.10
247.1251526	12.34
253.1517639	2.56
259.1292114	17.52
261.1478271	2.00
263.1592102	0.09
266.1033936	0.09
271.1754150	4.92
273.1429749	0.05
277.1511841	0.07
289.1871338	10.62
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	561.0646
Annotation	3,4',5,6-Tetrahydroxy-3',7-dimethoxyflavone 3-glucuronide
Peak:m/z	Relative Intensity
175.1440277	0.24
196.1389771	0.46
212.9660950	11.63
250.9868469	0.05
309.0405273	0.07
310.7706299	0.32
375.3430786	0.50
386.9349365	100.00
387.6791992	1.00
390.9695435	0.42
392.8607788	0.36
405.1149902	0.39
406.0224609	0.11
425.1834717	0.16
462.9387207	0.07
475.1104736	0.27
475.8535156	0.08
476.8731689	0.35
483.2958374	0.14
487.9317627	0.17
543.8312988	0.60
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	339.07
Annotation	Unknow
Peak:m/z	Relative Intensity
120.0536499	2.86
122.9258270	1.88
130.2664948	0.74
169.9387512	1.70
174.9488525	0.74
192.1357117	0.80
192.8553467	0.86
205.0426483	4.29
210.0264587	34.90
217.2947388	1.48
249.0993042	100.00
276.3341064	0.65
293.1083374	0.94
320.5687561	0.75
321.3807983	9.74
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	927.68
Annotation	Unknow
Peak:m/z	Relative Intensity
273.2659912	0.15
283.3094177	0.14
301.1043091	45.99
463.1754150	100.00
463.7850342	0.35
595.5214233	0.05
625.2904663	0.07
764.9175415	0.11
1415.2464600	0.07
1787.4415280	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	576.0981
Annotation	Unknow
Peak:m/z	Relative Intensity
171.1256104	0.06
219.1261902	0.15
235.3998718	0.20
249.2241669	0.09
250.9971466	0.04
257.3203735	0.07
257.9495850	0.03
267.1591187	0.18
272.9806519	0.11
274.2554321	0.12
275.3424072	0.04
280.8780518	0.09
283.2149048	0.04
288.0816650	0.05
290.8763428	0.26
308.1008301	0.04
314.3708496	0.07
316.7388916	0.58
324.5849609	0.10
337.2680664	0.05
348.1658325	1.77
357.1616211	0.12
358.1432495	0.07
362.3996582	0.11
363.9898071	0.09
379.3942261	0.07
380.3814697	0.06
392.5392456	0.06
395.3473511	0.13
403.4757080	0.12
412.1694336	0.16
412.9662476	0.29
414.3361816	0.08
417.5629883	0.09
423.8396606	0.11
426.9109497	0.06
428.4978638	0.68
429.1115723	1.89
430.1535645	0.05
443.4098511	0.09
444.9186401	0.46
446.1533813	1.47
447.1781616	0.33
468.2587891	0.05
477.5321045	0.09
481.4668579	0.13
483.0037842	0.19
484.3157959	0.13
486.2219238	0.36
487.2315674	1.27
501.2335815	0.10
512.2069092	0.04
515.1481323	0.05
518.1187134	0.13
530.1536255	0.05
539.5374146	0.16
543.3673706	0.36
544.9249878	0.15
558.1248779	100.00
567.1285400	0.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	318.18
Annotation	Isoleucyl-Tryptophan
Peak:m/z	Relative Intensity
113.0940933	0.15
119.0639954	0.05
130.0297089	0.09
130.9834595	0.13
131.9920502	0.07
133.1240387	0.05
134.3144836	0.08
135.2077026	0.08
141.1713104	0.28
155.1396027	0.24
157.0653687	0.15
159.0729370	0.12
160.9983826	0.07
167.1448975	0.18
168.6964264	0.10
177.9019775	0.05
179.2404175	0.19
181.8818970	0.07
183.3349915	0.06
185.2342682	0.15
188.1242981	13.35
189.2212982	0.10
192.0926514	0.08
199.1185455	0.16
201.2374573	0.06
205.0230408	100.00
207.2298279	0.06
210.8934937	0.05
213.1076050	0.15
217.4362183	0.44
218.9965210	0.10
228.6166382	0.30
229.3797607	0.13
235.6582947	0.27
237.4565735	0.10
238.1350403	0.05
241.1663513	0.14
243.0972900	0.13
248.8118896	0.46
250.9440308	0.14
253.0064697	0.13
255.1645203	0.84
256.5073853	0.04
258.0680542	0.24
259.8895874	0.18
261.2031555	0.31
262.5407410	0.38
269.1016235	0.86
270.0446472	0.04
272.1575317	1.90
272.8919373	0.74
274.1699524	0.10
276.3895264	0.21
277.0081482	0.37
279.7385864	0.61
281.3281250	0.04
282.2636719	0.17
283.1414795	0.50
285.2695007	0.10
287.1095581	0.34
288.2211304	0.05
289.5817566	0.33
297.9643555	0.05
300.0898438	5.40
301.1658325	1.73
309.1769104	0.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	344.1826
Annotation	Unknow
Peak:m/z	Relative Intensity
127.9526520	18.41
143.0375671	0.10
197.2122192	1.50
198.3517761	0.08
210.4921875	0.07
215.1582031	84.04
216.2093506	0.04
236.2639160	0.10
239.0684814	0.21
256.0307007	0.17
260.9409485	0.22
266.9122925	0.25
281.2087708	0.16
284.3784790	0.06
298.1439209	0.35
300.1204529	0.53
301.4011536	0.06
305.8640442	0.08
308.3002319	10.13
309.6010132	0.54
326.2533264	100.00
327.0311890	0.11
335.0151367	0.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	476.0638
Annotation	Unknow
Peak:m/z	Relative Intensity
147.2326813	0.40
177.2760315	0.20
219.2425385	0.42
263.0318604	0.22
283.9596863	0.74
302.2091675	0.26
316.0950928	0.18
339.1246948	0.42
340.5267639	0.78
344.2119751	0.28
347.1127014	3.39
360.4012756	0.61
369.4281311	0.20
413.1700134	100.00
414.1831360	0.36
430.5647278	0.53
447.2744446	0.33
453.9355774	0.85
457.7195129	0.94
459.3330383	7.94
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	787.2445
Annotation	Unknow
Peak:m/z	Relative Intensity
229.9321136	0.85
230.5500793	0.23
247.2509003	0.88
248.1304016	3.51
265.1248779	13.68
290.9200439	0.15
301.2156372	0.68
312.8983154	0.14
319.2536926	1.56
330.9066162	0.08
341.3287964	0.05
358.3299255	0.06
376.1974487	0.27
377.1982422	0.05
394.1956177	100.00
395.3487549	0.61
624.5886841	0.08
657.5508423	0.27
689.3613892	0.55
690.2027588	0.13
700.2794800	0.15
768.9534302	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	325.112
Annotation	D-Fructofuranose 1,2':2,3'-dianhydride
Peak:m/z	Relative Intensity
96.8424149	0.43
109.0161285	0.12
126.8416672	1.58
138.0591125	0.52
144.8819580	2.02
149.0848389	0.66
151.1760864	0.40
162.8844604	4.26
167.2970581	0.13
175.0656281	0.31
184.1155396	0.40
190.6023254	1.43
192.8644562	0.33
196.1698761	1.19
198.9483337	1.40
211.0762939	0.35
212.1334839	1.85
213.0578613	0.26
216.8456726	1.08
223.1186829	0.60
223.9931946	0.30
228.7234802	1.09
229.3583679	0.35
235.0427551	0.52
239.5381165	0.95
240.3692932	2.41
247.0761719	0.79
251.8609924	0.36
252.9514160	3.34
255.3671265	0.37
257.3939209	0.20
258.6068726	5.65
259.3467407	1.11
268.1585083	100.00
269.2394714	17.26
270.9119568	10.08
271.5900269	0.06
276.7462158	0.45
278.3627319	0.12
279.1549683	0.16
280.2391357	0.87
286.1931458	0.18
287.3047485	2.03
288.9708557	43.05
307.0329285	5.97
308.4886475	0.61
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	318.09
Annotation	Unknow
Peak:m/z	Relative Intensity
156.3211670	0.59
167.0275879	0.58
186.3532562	0.35
193.4027252	0.74
194.0808716	0.72
196.1810913	1.77
201.3642273	0.81
210.1916809	0.81
213.1974487	1.07
228.1324463	100.00
229.1601257	0.65
248.2156372	2.43
259.2540283	0.56
260.3073730	0.72
272.1453552	1.53
273.5614014	2.09
274.3749084	0.35
277.3815613	0.17
290.2780457	0.68
300.1897583	2.43
301.2776489	1.07
303.5659790	1.65
304.8637695	1.13
307.6798706	0.62
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	293.1157
Annotation	N-gamma-Glutamyl-S-propylcysteine
Peak:m/z	Relative Intensity
73.7994690	0.04
86.8436890	0.49
100.9213715	0.09
104.7949982	3.55
118.0182800	0.78
123.7971573	0.04
129.9167633	0.20
144.1268921	0.03
145.0651245	0.34
147.0472412	95.82
148.0844727	0.21
162.1695099	0.53
164.0164490	100.00
170.0650635	2.27
171.1737061	0.39
172.1614075	0.61
188.1991425	0.14
197.2091675	0.16
217.2990112	0.05
229.5249023	0.06
230.1921692	2.05
234.0274963	0.03
236.0970459	0.15
237.2971191	0.04
241.1912842	0.15
245.9187012	0.06
247.0393677	0.51
257.1126709	0.16
275.2043762	1.36
276.2318726	7.60
293.2371216	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	867.2341
Annotation	Lantanose A
Peak:m/z	Relative Intensity
342.0518799	1.09
363.0862732	5.58
381.1441040	10.40
525.3056641	50.20
527.9970703	0.78
543.3660278	21.28
633.5276489	1.53
669.9946289	0.78
687.4331665	5.60
695.9188843	6.20
705.3919067	100.00
706.0064087	0.24
774.5016479	1.58
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	534.105
Annotation	Unknow
Peak:m/z	Relative Intensity
159.9937592	0.31
162.1264801	0.16
179.0486755	0.23
202.0120392	0.76
219.1129303	4.64
245.3627167	0.17
268.1624756	0.19
273.2347412	0.44
274.8970947	0.07
283.4102783	0.36
286.3507080	0.18
288.2767334	0.09
305.9886475	0.23
307.1181030	8.24
315.1480103	0.29
330.3771362	1.34
332.5068970	0.07
339.1140747	0.41
348.1766968	100.00
348.7948608	0.36
372.6691284	0.90
386.5342407	0.10
387.5510254	0.20
397.0944214	69.07
404.0629883	2.16
405.0977783	4.34
422.2182617	0.74
427.6217041	0.30
431.1179199	0.12
443.5714722	0.11
444.2991943	0.19
453.8580322	0.25
459.1577148	0.31
462.2622070	0.26
469.4702148	0.71
475.7568970	0.31
484.0006104	0.62
505.2988892	0.21
516.1005249	28.78
525.7601318	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	636.326
Annotation	Unknow
Peak:m/z	Relative Intensity
196.1246643	0.04
196.8301697	0.14
199.1192627	0.40
201.2080078	0.17
242.1556702	0.07
243.3554688	0.18
244.1126709	0.44
245.2267456	0.17
246.0500488	0.12
289.2484741	1.05
290.1502686	1.10
291.0653687	0.92
292.3726196	0.07
324.2717285	0.31
325.3551025	0.06
328.1446533	0.10
333.2670593	0.10
343.4321899	0.88
344.2851562	0.83
345.2281494	0.86
346.3292236	4.57
347.2990112	0.25
348.4749756	0.15
362.2200928	0.66
387.9793701	0.13
389.2651367	2.76
390.2647095	7.15
391.2772217	4.81
392.2811279	2.42
393.8897095	0.13
444.4251709	1.02
445.3859863	0.93
446.0529785	35.30
446.6930542	0.22
461.7874146	0.18
463.6099854	0.03
468.4561157	0.19
471.1781616	0.17
476.0576172	0.06
488.0826416	0.46
489.5353394	9.85
490.1858521	100.00
492.2255249	0.23
544.2119751	0.05
546.2273560	0.04
572.0507202	0.22
589.3864136	1.19
590.1790161	3.63
600.0463257	0.13
618.2665405	1.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	680.2079
Annotation	Unknow
Peak:m/z	Relative Intensity
221.1417542	0.06
250.6065369	0.08
251.2592316	0.06
323.2449951	1.02
338.0054932	0.05
340.9697266	0.44
341.8574219	0.01
382.8233032	0.01
383.6067505	0.16
485.4194946	0.02
503.3870239	100.00
504.4229736	0.03
505.4058838	0.02
518.2966919	0.05
572.4938965	0.02
589.2933960	0.05
649.0623169	0.03
662.5014038	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	314.2683
Annotation	Palmitoylglycine
Peak:m/z	Relative Intensity
94.9013672	0.05
103.5902405	0.04
104.8157578	0.05
106.7331848	0.11
109.0061798	0.17
110.0510406	0.09
121.0267181	0.06
135.0123291	0.37
136.1305695	0.08
137.1383667	0.06
140.0003662	0.11
141.1674194	0.07
147.0437622	0.24
147.8713531	0.20
149.1774292	0.16
163.1904297	0.03
171.1543884	0.09
173.1676331	0.05
177.1598663	0.07
181.1645508	0.04
190.2147827	0.04
205.2228394	0.10
209.1304932	0.04
210.0314636	0.03
212.0421143	0.05
217.3355103	0.30
219.1535339	0.41
220.2988281	0.04
223.2541809	0.07
229.0649719	0.28
230.3713379	0.03
231.3628845	0.09
235.2188721	0.35
236.6665955	0.82
237.2857666	1.24
240.1408691	0.05
242.2808533	0.13
243.2603455	0.15
249.3665466	0.95
250.3194275	0.14
255.1772156	1.49
260.4001465	0.64
261.3242798	0.56
265.4011841	0.06
266.2752686	0.26
267.2868652	0.71
268.0824890	0.06
270.3873901	0.09
273.2345276	0.17
278.2884521	10.77
279.2030029	0.52
283.3042603	0.22
285.4846191	0.14
286.2807007	0.20
290.1374512	0.08
292.8847656	0.18
293.9539795	0.15
296.2856140	100.00
297.0963440	0.60
313.7711182	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	325.1119
Annotation	Lactulose
Peak:m/z	Relative Intensity
97.2670441	0.15
98.9999924	0.03
109.0104218	0.13
117.1085358	0.05
127.0007324	1.23
130.0443115	0.08
131.0180359	0.01
132.0916595	0.05
133.0665588	0.05
134.9372864	0.07
139.1473236	0.03
144.8628235	1.57
149.2885132	0.02
152.9163513	0.03
161.0687714	0.07
162.9300385	3.56
173.9556274	0.03
174.9487610	0.09
180.0536194	0.07
181.0161133	0.12
184.0096130	0.45
189.0293274	0.20
192.6049500	0.23
193.2130127	0.17
194.1229095	0.10
195.0843658	0.07
199.1208191	0.34
205.2187195	0.06
206.8952026	0.10
208.3576355	0.13
211.0526123	0.29
212.1570740	2.40
213.2096863	0.18
217.1012878	0.66
221.9774170	0.09
223.1239319	0.42
225.1071167	0.14
229.1741638	0.63
235.1123962	0.16
237.1858521	0.04
239.0318604	0.07
240.8139343	0.78
243.3341980	0.04
247.0770569	1.13
248.5237427	0.03
252.9504089	2.90
255.4638367	0.10
257.6691589	0.27
258.8656006	3.79
260.9725037	0.05
264.9638367	0.20
268.2001343	100.00
269.1776733	17.75
271.0666504	6.28
278.7295532	0.10
279.6710815	0.20
282.5134888	0.02
284.6094360	0.06
285.4750977	0.08
286.9969482	0.17
288.1274414	3.03
288.9114990	24.09
289.5401917	0.35
293.1712952	0.06
295.3029480	0.11
296.4528198	0.06
299.8209229	0.04
307.0172119	2.27
308.2598877	0.32
309.4273682	0.09
317.3762207	0.02
338.8257751	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	598.0494
Annotation	Unknow
Peak:m/z	Relative Intensity
202.0660706	1.22
210.9410095	4.07
219.1167450	15.24
251.1667786	1.48
283.4702759	2.51
284.4080811	1.64
307.1934204	3.57
314.9567871	20.00
338.3598633	2.98
339.4515381	8.63
348.1005859	1.89
366.0688477	1.99
403.2693481	0.97
413.0852661	100.00
443.5429077	4.49
444.2663574	3.37
445.1887817	3.10
469.1084595	75.18
492.2583008	2.97
509.0647583	2.77
523.4393311	0.97
579.8844604	13.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	492.06
Annotation	Unknow
Peak:m/z	Relative Intensity
177.1171112	0.34
208.9315796	9.23
211.4707031	0.55
255.4378052	0.50
256.1320190	0.55
257.0507507	0.89
268.0216064	1.51
298.9954224	0.41
306.0557251	0.30
312.7909546	0.58
327.2018433	0.43
331.0299683	0.71
338.1110840	3.11
339.0428772	1.30
345.6717529	0.30
351.5132751	1.58
361.3518066	0.79
363.1068115	100.00
371.3610840	1.12
393.5788269	0.94
402.2738647	1.54
405.1360474	0.91
414.9934998	3.77
417.0943909	15.24
423.7777100	0.43
432.3474426	0.55
447.1311951	0.77
455.8839722	0.62
460.1263428	2.56
474.4573059	1.12
475.3114929	3.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	380.0959
Annotation	Unknow
Peak:m/z	Relative Intensity
126.0080032	0.03
127.9206238	4.61
134.7788086	0.17
143.0253296	4.59
145.2239685	0.14
146.0029907	0.61
153.1527863	0.20
155.0281830	0.06
158.0421600	0.05
159.8762512	0.36
166.2011414	0.10
167.0914917	0.60
169.1445160	0.28
170.1477966	0.15
171.0925598	0.58
175.0210266	1.19
179.1342773	6.72
181.1462708	0.03
185.0978088	2.25
192.2279358	0.07
197.1749268	0.88
201.1914978	0.06
203.0449371	0.32
207.9646301	0.05
210.2079773	3.58
212.9826660	0.07
218.0272217	0.04
226.2317200	0.07
227.4682312	0.11
228.1635742	0.09
233.0019531	0.03
233.9091797	0.05
236.1842957	0.14
242.1974487	0.10
251.1823425	2.46
252.1492615	0.25
254.1732788	53.06
259.3617554	0.03
268.1246338	0.10
272.2109680	100.00
273.2368774	0.10
274.2730103	0.19
286.1697998	5.22
287.5234070	0.03
288.2031250	0.11
293.1775208	0.04
304.1419067	13.16
306.1495361	0.45
307.2300720	0.04
320.3931885	0.02
333.3739014	0.24
334.0864563	0.05
359.4581299	0.07
362.2062378	21.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	625.1406
Annotation	Myricetin 3-neohesperidoside
Peak:m/z	Relative Intensity
179.1557312	0.03
193.2064056	0.01
212.0746765	0.01
227.1254120	0.00
227.9837799	0.01
230.4580078	0.01
240.2412720	0.02
255.0671997	0.01
257.0752869	0.02
269.0024414	0.01
271.1909790	0.02
273.1256104	0.01
274.4562988	0.02
284.3397522	0.01
296.6268616	0.01
299.2319336	0.20
301.1360779	14.20
302.1100464	1.88
313.0917969	0.02
314.2294922	0.08
315.0797119	0.03
320.4318237	0.01
330.2603760	0.01
336.9617310	0.01
343.3059082	0.09
373.2340088	0.03
445.4357910	0.01
463.1762085	100.00
464.2553711	6.39
505.1419678	0.01
506.1397705	0.02
557.0408325	0.02
597.3820190	0.07
607.2109985	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	246.12
Annotation	4-Acetamidoantipyrin
Peak:m/z	Relative Intensity
75.75430298	25.29
84.20217896	9.43
156.2925568	15.02
170.8554382	18.59
172.0576324	16.82
184.0203247	29.24
186.207901	23.27
188.0316467	4.40
188.7887726	3.09
197.8582458	6.52
200.1357574	43.86
205.0498199	3.59
219.310791	7.38
228.1161346	100.00
237.8192902	28.74
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	439.1817
Annotation	Unknow
Peak:m/z	Relative Intensity
149.1974182	0.14
163.0496979	2.31
175.8188629	0.11
192.9159851	0.10
204.8572083	0.15
234.2481232	0.08
235.2633972	0.49
246.5729065	0.04
247.3082886	0.11
257.0608215	0.17
259.2604980	0.16
260.2493286	0.26
264.7280579	0.84
265.3596802	0.19
276.3870544	0.21
277.3096008	0.09
307.3260498	0.05
308.7231140	0.24
320.0426941	0.17
325.0928650	1.05
343.1835632	0.33
345.2758484	0.14
349.0997009	0.11
351.5971680	0.10
352.4869385	0.11
358.1993713	0.37
366.0461121	0.10
367.4698792	0.20
374.1861877	0.15
375.4994202	0.15
378.2215271	0.23
383.2897644	0.17
393.3219910	100.00
394.8248291	0.39
395.5585938	0.21
402.2117615	0.07
403.2842102	0.32
411.4919739	0.37
419.2924194	0.17
421.1177063	0.29
421.8302612	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	773.3636
Annotation	Unknow
Peak:m/z	Relative Intensity
251.2307739	0.40
274.9264526	0.40
425.1810913	33.84
463.5034790	0.41
499.4624023	0.40
513.2943115	0.13
519.3698120	0.64
520.4724731	0.22
561.2929077	1.36
599.0599976	100.00
605.0025024	1.08
617.9834595	2.37
688.7129517	1.62
720.1281128	0.27
726.8551636	0.38
758.6205444	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	554.1658
Annotation	Baumycin C1
Peak:m/z	Relative Intensity
166.2173615	0.01
167.1794281	0.01
170.0614929	0.02
171.1262665	0.05
177.1329956	0.03
179.2150116	0.50
180.6480865	0.05
185.2196655	0.05
193.4048157	0.01
197.1244354	0.03
199.3125610	0.06
200.1085052	0.34
201.2010803	0.04
209.1574402	0.06
210.2302551	0.48
211.2088623	0.01
212.1855774	0.04
215.1978912	0.02
217.4584351	0.01
219.0348053	0.03
224.2972870	0.01
227.1767426	0.02
228.3503723	0.12
230.1281738	0.03
236.2782288	0.04
240.4002991	0.09
252.0811157	0.02
254.2397003	4.87
255.2805634	0.25
261.3118896	0.03
263.2358398	0.67
264.2807922	0.05
268.0920410	0.01
269.3349609	0.06
270.1721802	0.19
272.2121582	7.94
273.2587280	0.36
275.4663086	0.01
279.6340942	0.01
280.4658203	0.01
282.4574585	0.06
283.3170166	0.02
288.1557617	0.41
289.1572266	0.07
290.2289124	0.77
291.2803345	0.05
292.2407837	0.02
293.1976929	0.03
294.1422729	0.04
294.9974976	0.01
296.2001953	0.11
297.3919067	0.01
300.3224487	0.10
301.2307129	0.02
304.0531006	0.02
306.2102661	3.93
307.2849121	0.26
308.1990967	0.02
310.2543640	0.01
312.2754517	0.18
313.2460938	0.01
314.4712524	0.03
315.3432007	0.01
318.3989258	0.06
319.1456909	0.03
324.3303223	0.48
325.4664917	0.05
326.2777710	0.72
327.3521118	0.06
328.4226074	0.04
334.2308350	0.01
336.2122192	1.17
337.3414917	0.08
338.1517334	0.07
339.3049927	0.04
341.5192871	0.01
342.3736572	0.17
344.1983032	0.31
345.5042114	0.01
346.6641235	0.06
347.5415649	0.06
348.4265747	0.11
349.4136353	0.06
354.3006592	1.72
355.3563843	0.11
356.1987915	0.03
357.2551270	0.00
358.2495117	0.10
359.2880859	0.05
360.3626099	0.17
361.4108276	0.02
362.4191895	0.03
364.5107422	0.03
368.4148560	0.08
370.3011475	0.30
371.0974121	0.04
372.3546753	2.45
373.2499390	0.33
374.2386475	2.19
375.4219971	0.13
376.4544067	0.14
378.2773438	0.14
379.4353027	0.01
380.4895020	0.06
381.1636353	0.02
386.3667603	0.03
387.3544922	0.01
388.3487549	0.60
389.8777466	0.11
390.4829712	1.34
392.2729492	100.00
393.3317871	7.41
396.4437256	0.01
398.2848511	0.41
402.1427612	0.09
404.2743530	0.11
404.9424438	0.02
406.3760986	0.69
407.5253906	0.09
408.3485107	0.04
410.2098999	0.01
413.6647339	0.01
414.3674316	0.32
416.3063354	2.64
417.3849487	0.26
418.3900757	0.01
420.3120117	0.36
421.5065308	0.03
424.1665649	0.23
425.3051147	0.03
426.0358887	0.05
427.3692017	0.02
428.4360962	0.08
429.8643188	0.01
431.3438721	0.04
432.3634033	0.61
434.2661743	5.35
435.3564453	0.57
444.2320557	1.42
445.2840576	0.28
446.2673340	0.82
447.2383423	0.06
450.3040161	0.25
456.2358398	1.02
457.1523438	0.06
458.2458496	0.15
462.3905640	1.62
464.2463379	13.97
465.3216553	1.39
468.2376709	0.83
469.5463257	0.02
474.2645264	2.17
475.2896729	0.30
476.2441406	0.34
477.0839844	0.03
488.2964478	0.06
489.1099243	0.01
490.3948364	0.02
492.2788086	7.84
493.2834473	1.12
494.2820435	1.95
495.3316650	0.28
500.3776245	0.07
506.3926392	0.13
507.2963257	0.04
508.0711060	0.02
508.7369995	0.02
510.3129272	3.61
511.4086304	0.40
518.2240601	0.37
519.3841553	0.05
536.2857056	6.86
537.3436279	0.97
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	418.8947
Annotation	Unknow
Peak:m/z	Relative Intensity
131.0384521	0.07
175.0344543	0.58
230.1680603	0.05
244.9970093	0.09
255.1104736	0.10
273.0796509	1.61
274.0851746	0.17
275.1145325	0.13
289.0093384	25.33
302.9849243	0.07
304.9985962	100.00
329.2529602	0.24
329.9834595	0.18
344.0828552	0.20
345.2732849	0.23
347.0819092	0.08
348.0684509	0.09
361.7261047	0.03
362.9731445	0.14
371.9015198	0.05
373.9174500	0.45
374.9928589	0.08
380.8854065	0.04
386.2207336	0.07
402.2531433	0.10
409.1510315	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	477.1038
Annotation	Pedaliin
Peak:m/z	Relative Intensity
136.7987366	0.03
145.1259003	0.02
146.9596710	0.05
147.9553680	0.07
149.2167969	0.01
151.0951385	2.72
151.9979553	0.10
153.0841217	0.62
154.1437683	0.33
157.9997406	0.06
160.2743683	0.03
161.0549316	0.16
162.0778809	0.04
163.1295013	0.32
163.9695740	0.29
165.0694427	0.06
169.0095215	0.33
170.2482147	0.03
172.8400574	0.15
175.8801270	0.14
177.1330719	0.09
178.9798126	1.83
180.0428467	0.20
181.1287842	0.20
185.3152466	0.09
186.1326294	0.03
187.3185577	0.04
188.1777344	0.07
189.0505066	0.34
190.1022797	0.37
191.2003174	0.09
192.1179504	0.06
193.1973877	0.49
194.2067108	0.06
194.8670349	0.02
196.3654633	0.02
199.1398926	0.05
200.1788330	0.03
201.1577454	0.53
202.2027893	0.18
203.3012695	0.18
204.0552826	1.05
205.2346344	0.53
206.1136780	0.12
207.1191101	0.28
209.1233063	0.01
211.4594421	0.04
214.2293091	0.11
215.4062195	0.02
216.3481445	0.04
217.1871185	0.50
218.2214661	0.06
219.2053223	0.18
220.1938782	0.09
221.1117554	0.34
223.3456726	0.04
224.2483826	0.10
226.2730408	0.02
229.1338348	0.20
230.9004974	0.09
232.2996979	0.03
233.2397156	0.55
234.1422577	0.07
235.2269592	0.10
238.3791046	0.03
239.3757629	0.04
240.4339905	0.08
241.3485107	0.07
242.0314941	0.12
243.1111145	1.97
244.2312622	0.30
245.0631714	0.44
249.1576233	0.34
250.2219238	0.04
252.3210144	0.07
253.4085999	0.01
254.3039246	0.02
255.1529236	0.12
257.0682373	0.84
258.0734863	0.15
259.2674561	0.19
261.1782837	0.14
262.1663208	0.03
263.2788391	0.10
264.2939148	0.08
267.0774231	0.08
268.5491943	0.24
269.2494507	0.13
270.2796021	0.62
271.1647949	6.05
272.1794128	1.07
273.1981506	2.49
274.1585693	0.36
275.2174683	0.26
276.1381226	0.14
280.2389832	0.05
281.2519226	0.57
282.2069092	0.13
283.2111816	0.36
285.0872192	8.10
286.1901855	4.34
287.2789307	0.91
288.6261902	0.18
289.2973633	0.74
290.1835938	0.01
291.3400269	0.05
295.2884216	0.21
296.3032227	0.04
297.1273804	0.17
299.0662231	6.42
300.2167969	3.34
301.1593323	0.45
302.2684021	0.03
303.1272278	0.21
305.2536316	0.10
307.5258789	0.02
308.4651489	0.03
309.2039185	0.03
310.1528931	0.09
311.3039856	0.22
312.2027893	0.15
314.1428528	100.00
315.1637573	50.19
316.2437439	7.62
317.1392212	0.17
325.1635437	0.42
327.1310120	0.90
328.1395264	0.20
329.1720581	3.21
330.3201294	0.87
331.3988037	0.04
332.7006226	0.09
337.2899475	0.13
339.2108154	0.08
340.2903442	0.04
342.1580200	1.21
343.2164001	0.32
344.1885986	0.20
345.1673584	0.07
351.2940674	0.04
353.2362671	0.19
353.9430847	0.03
355.1885376	0.05
357.1952209	23.80
358.2704163	4.00
359.4363403	0.13
366.1687317	0.03
368.1578674	0.07
369.1705322	0.05
370.2485046	0.08
372.2837830	0.11
373.1104126	0.01
381.1521606	0.14
382.5784607	0.01
386.3120422	0.03
387.2839661	2.20
388.0648499	0.44
397.4684143	0.02
399.3196106	0.26
400.0357361	0.10
409.3916931	0.02
413.4227905	0.08
415.3750916	0.04
417.1376343	0.18
418.2157593	0.10
423.6029358	0.02
430.0731812	0.01
431.5523987	0.33
433.4214172	0.23
434.6084290	0.12
441.5949402	0.16
442.3863220	0.02
445.3576355	0.11
446.3700562	0.04
449.3451538	2.04
450.2447205	0.45
459.2705078	0.77
460.0457153	0.12
462.1219788	1.34
463.1509705	0.29
489.9965515	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	370.0823
Annotation	Lansoprazole
Peak:m/z	Relative Intensity
126.9928589	0.63
145.0275879	6.43
147.1601257	0.45
156.1550903	0.44
162.7610474	1.44
176.8397217	0.80
207.9731445	0.16
218.1326904	0.31
235.1509094	0.20
253.0848389	0.61
270.8618164	7.95
280.0296021	100.00
281.0014038	2.12
282.5630188	0.96
287.8601074	0.30
289.0633545	98.07
289.9146118	0.14
291.4620056	0.92
292.4067993	0.83
293.7155151	0.84
295.2244873	0.60
300.7420654	0.44
302.9413757	0.46
309.5331726	0.15
311.2919006	0.40
319.7227173	0.59
325.4081116	0.68
328.3614502	0.63
342.1907959	0.13
351.2651672	0.25
352.2033081	1.32
353.2544250	0.64
354.7313843	0.54
361.1845703	5.05
379.0719299	0.89
397.1314087	7.94
398.0615540	0.27
415.0942078	4.85
456.6531372	0.44
469.0685730	0.35
486.5451050	1.35
487.2363892	1.82
516.5557861	3.43
517.2402954	2.93
559.0391235	5.65
575.3867798	0.27
577.0127563	23.20
577.6209717	0.44
700.6522217	0.37
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	429.08
Annotation	Unknow
Peak:m/z	Relative Intensity
154.6113739	0.08
168.9981995	0.04
171.8902435	0.04
180.2821350	0.16
214.2074280	0.23
219.0475769	0.09
220.0552216	0.66
227.1358490	0.03
261.9557800	0.09
264.0208435	9.81
265.1755066	0.69
265.9283447	0.12
281.0918579	0.08
282.0293579	0.08
290.3605347	0.30
291.0455017	0.83
294.2772522	0.07
299.1923828	0.21
306.2730713	0.28
307.8754883	0.28
309.9732666	0.10
314.1756897	0.08
316.1757812	0.05
338.7355347	0.05
341.2166748	0.43
342.4199219	0.04
343.3064880	0.24
344.1327820	0.10
355.1561584	0.14
366.2986755	0.56
382.1917725	5.53
383.1987610	100.00
384.1496887	2.39
385.1763611	19.80
385.8471680	0.07
400.2121277	2.03
401.0551453	10.41
409.9919128	0.20
411.2844849	0.56
412.0205994	0.04
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
105.0001984	0.05
128.0274353	100.00
130.1432037	1.37
152.9367676	0.13
199.4225922	0.10
213.1419525	0.36
215.1330109	0.18
223.1494293	5.67
229.0370331	0.23
230.3344421	0.09
241.1259155	59.90
257.0582581	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1331.4384
Annotation	Lychnose
Peak:m/z	Relative Intensity
383.1348267	0.20
485.1893921	0.40
503.1495361	0.64
575.5348511	0.34
665.3179932	100.00
665.9307861	0.40
1292.3477780	0.03
1312.4390870	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	293.1448
Annotation	3-Ureidoisobutyrate
Peak:m/z	Relative Intensity
83.7077026	0.06
100.7051544	0.09
129.9660797	6.36
146.9972534	100.00
174.9804993	0.09
230.9946289	0.18
247.2750244	0.11
269.1168518	0.14
275.0729980	0.13
275.7474365	0.39
291.2896729	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	665.2571
Annotation	Unknow
Peak:m/z	Relative Intensity
203.0727844	0.98
251.9757538	0.02
270.3275757	0.67
271.3925476	0.10
288.0115051	0.02
295.2014771	0.02
296.3074951	0.03
306.1557007	0.31
314.3175354	9.01
315.4323120	0.09
332.1861572	100.00
333.3027344	0.65
370.1494751	0.10
384.1176758	0.07
460.6025391	0.16
467.2940674	0.06
470.4501953	0.03
485.2146606	0.06
516.3684692	0.03
528.0610962	0.04
533.5901489	0.04
536.4863892	0.06
551.1558228	0.03
555.1351929	0.13
569.2233276	0.03
588.6416626	0.10
591.3807373	0.14
613.2036133	0.09
620.0624390	0.08
627.1732178	0.57
628.1093140	0.02
638.1156616	0.25
645.2949829	0.13
647.0283813	0.24
647.8930054	0.13
648.5878906	0.33
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	410.0517
Annotation	Unknow
Peak:m/z	Relative Intensity
127.9280548	0.84
134.9730530	0.12
143.0428314	0.62
145.0401917	0.10
151.0832367	0.04
160.1666412	0.25
166.2377930	0.19
169.1028442	0.17
170.9665527	0.04
175.0182190	0.97
176.0568542	0.05
176.9681702	0.06
179.1006165	1.08
181.1318970	0.04
182.3841858	0.04
183.1934509	0.02
183.9783936	0.10
185.1385040	0.19
192.2356873	0.16
197.1470490	0.73
200.1395569	0.13
203.0976868	0.06
208.0249329	0.21
209.1443481	0.23
209.9791260	0.67
211.0776215	0.13
214.2177582	0.04
226.1296692	0.56
228.2616272	0.26
230.1531372	0.28
235.3288574	0.16
245.3326111	0.04
246.3754272	0.21
247.1341248	0.08
252.3128662	0.67
254.1919556	6.60
260.1657410	0.10
263.2077637	0.22
272.1368713	31.82
274.3718262	0.09
278.1047363	0.16
279.1783752	0.03
281.1885376	0.11
286.2139893	8.53
288.1055298	0.27
297.3655396	0.09
302.2321167	0.06
304.1412964	100.00
306.1925354	3.05
310.4056396	0.10
313.1426697	0.04
314.2478027	0.05
318.2991333	0.55
319.2221680	0.38
320.1990967	0.40
321.4237366	0.07
331.9529419	0.10
337.0510864	13.24
338.1750488	2.23
340.4356079	0.15
344.2237549	0.14
346.2187195	0.09
347.1331787	0.04
350.3846741	0.10
352.1909180	0.07
361.4220276	0.04
363.2669678	0.32
364.2768860	0.24
366.3558350	0.17
372.1390076	0.22
373.2181091	0.03
374.2016907	0.49
376.2379456	0.07
379.5068665	0.08
391.5043640	1.58
392.2187195	5.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1065.3378
Annotation	Unknow
Peak:m/z	Relative Intensity
494.0590820	1.22
1023.4011230	0.43
1138.7755130	0.93
1286.3819580	0.14
1459.3343510	0.46
1469.2542720	0.21
1513.6558840	0.21
1555.0744630	0.25
1571.6265870	1.78
1616.9493410	0.34
1623.2390140	0.48
1662.0074460	0.65
1688.9244380	0.41
1691.7767330	0.39
1721.1864010	0.32
1723.0826420	0.99
1730.8494870	0.21
1736.7554930	0.76
1738.8416750	0.43
1745.6651610	0.19
1746.9185790	0.34
1757.0549320	0.39
1760.2535400	3.18
1768.1663820	3.61
1775.6257320	0.28
1794.2723390	1.60
1797.2210690	0.41
1797.8450930	2.06
1800.4696040	1.36
1801.8117680	3.31
1805.6756590	0.25
1806.7637940	4.29
1812.5601810	0.58
1813.6768800	1.33
1815.1168210	0.18
1816.8044430	1.21
1822.5466310	8.85
1824.4896240	0.48
1835.1164550	1.24
1837.5651860	0.41
1839.3724370	0.32
1840.8177490	0.41
1850.3161620	1.09
1854.7467040	0.89
1855.7257080	0.80
1858.0445560	11.81
1860.2716060	1.49
1862.1353760	0.77
1864.2464600	2.62
1869.6839600	0.73
1874.0006100	2.18
1875.6755370	26.43
1877.2824710	0.71
1878.0939940	3.46
1879.0103760	0.27
1880.3776860	49.78
1881.7653810	0.39
1883.0905760	2.68
1888.3049320	1.79
1890.2390140	7.28
1892.5328370	1.02
1893.4293210	9.80
1894.8331300	48.94
1898.8135990	3.20
1899.5588380	2.90
1900.9035640	0.94
1902.5441890	1.08
1903.6883540	0.25
1906.0037840	2.06
1906.8057860	5.57
1909.1239010	5.99
1910.0010990	2.77
1911.0535890	1.89
1912.0140380	0.61
1913.3028560	3.89
1914.8416750	0.57
1916.1087650	0.68
1917.0251460	0.27
1919.2995610	3.22
1921.0260010	0.75
1928.8424070	3.89
1930.0373540	0.54
1931.3182370	0.83
1933.3868410	10.58
1934.4752200	1.85
1936.5772710	9.50
1937.2896730	1.76
1938.6696780	3.84
1939.8693850	6.64
1940.6820070	0.57
1942.2921140	1.13
1944.2725830	4.41
1945.2432860	3.29
1948.8684080	21.39
1950.5482180	0.23
1952.0487060	2.87
1953.2380370	4.37
1954.1931150	6.59
1955.4210210	7.88
1956.1037600	1.93
1957.1267090	10.43
1958.0982670	0.54
1959.6876220	1.69
1961.4224850	28.20
1963.2318120	3.43
1965.0897220	28.77
1965.8470460	5.57
1967.0852050	2.88
1968.0256350	6.85
1969.5461430	31.40
1970.1732180	0.84
1970.8470460	0.53
1971.5924070	2.72
1972.4447020	0.19
1973.5059810	0.64
1974.2386470	0.97
1974.9251710	0.60
1976.1993410	10.45
1977.3610840	38.62
1978.2595210	0.74
1979.2388920	20.12
1981.3226320	41.30
1983.7923580	2.11
1985.8975830	0.98
1987.7116700	2.04
1988.9006350	1.17
1990.1589360	2.97
1991.1722410	43.21
1991.9366460	10.86
1993.2976070	100.00
1994.1726070	1.42
1996.8366700	31.05
1998.3649900	2.90
1999.8846440	38.77
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	288.9366
Annotation	Unknow
Peak:m/z	Relative Intensity
87.0384979	0.02
102.9100418	0.02
114.9193420	0.69
130.8773804	1.77
147.0158844	0.91
158.9250336	9.03
174.8890686	100.00
199.9014587	0.02
214.9835815	0.07
217.0199585	0.04
233.0148010	0.17
244.9997559	25.91
260.9689941	0.60
271.1179199	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	394.1268
Annotation	(gamma-Glutamyl-gamma-glutamyl)-S-methylcysteine
Peak:m/z	Relative Intensity
117.0288391	0.07
126.8290634	0.17
129.9490662	0.06
143.9478760	0.72
162.0530090	3.31
171.7902527	0.40
179.1734619	0.05
230.0026245	4.95
247.1140747	2.51
248.0148621	10.49
265.0772095	100.00
274.1870117	0.04
290.5433044	0.28
291.3066406	0.07
301.0801697	0.14
305.8622437	0.08
319.1855164	3.13
331.2244263	0.28
376.2917480	1.63
377.1346741	0.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	470.1069
Annotation	Tuberosinone N-beta-D-glucoside
Peak:m/z	Relative Intensity
160.1927490	0.08
162.0234375	0.12
170.2352295	0.08
175.9975433	0.29
178.9337158	0.13
185.1469421	0.17
202.0596313	0.21
210.9703217	0.55
217.1463470	1.97
219.1339569	7.50
231.1083832	0.06
233.0316620	0.17
237.6271515	0.05
251.0837402	10.59
273.1418152	0.29
274.2367249	0.04
283.3473816	0.02
305.1715393	0.43
306.4540405	0.25
307.2126770	0.21
308.2150269	0.09
317.0750427	0.10
322.2246704	0.09
323.2154236	0.21
325.2153320	0.05
329.9223633	0.15
330.6450195	0.03
340.9869080	21.75
348.2631836	20.96
352.4272766	0.27
362.3388062	0.15
364.4010620	0.06
378.8267517	0.04
380.1291809	100.00
380.7575378	0.33
383.8959045	0.03
395.1104431	0.79
397.3865356	0.05
409.4873962	0.04
420.4338684	0.09
421.1016846	0.04
433.4099121	0.11
452.1318359	13.07
452.7546692	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	411.0597
Annotation	Unknow
Peak:m/z	Relative Intensity
139.1850891	0.08
198.1320801	0.05
213.0502777	0.10
224.3395538	0.17
228.1507263	0.05
246.8908386	0.25
254.4308777	0.18
262.2678223	0.06
263.4685059	0.09
272.1748047	1.25
279.3207703	0.10
303.8410339	0.06
305.3311768	0.19
306.3153076	0.34
309.3698730	0.10
313.1801758	0.19
319.5032959	0.14
322.1131592	0.06
334.4688721	0.09
335.3873901	0.08
346.3309021	3.20
347.3262329	0.05
349.3770752	0.13
360.1635437	0.31
363.3025818	0.04
364.2698975	0.15
365.2297668	1.73
366.6669617	0.52
367.3472595	0.16
373.1809998	0.05
374.6574402	0.50
378.1803284	100.00
381.1015930	0.09
383.2532043	0.18
384.1374512	0.16
391.8642883	0.06
393.2285156	0.85
397.2279053	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	548.069
Annotation	Unknow
Peak:m/z	Relative Intensity
166.9501038	0.03
168.9692078	0.04
169.7935181	0.02
179.1356201	0.10
197.3328552	0.05
203.1590424	0.16
210.1795349	0.10
228.2636414	0.02
231.1360321	0.04
231.8816376	0.05
236.0216675	0.04
243.2407837	0.16
245.2929688	0.05
249.1418152	0.50
252.1292725	0.04
254.1846924	0.38
255.1033478	0.03
262.3389282	0.02
270.1752930	0.04
272.2629395	2.27
273.1713867	0.44
283.0619507	0.02
286.0498962	0.20
287.0756836	0.12
288.1836548	0.10
304.1714478	1.95
305.3616333	0.32
306.1893616	1.32
306.8941040	0.20
321.2287598	0.13
328.5107422	0.11
337.1306152	0.31
338.2455444	0.14
343.1065674	0.04
344.4768677	0.02
346.2094116	0.68
347.4035645	0.17
348.0590210	0.05
352.4362183	0.05
359.0424194	0.02
360.1887207	0.81
361.3453979	0.02
368.1028442	0.05
370.2802734	0.02
378.1586304	45.53
379.1635132	6.72
383.2782593	0.02
393.1150513	0.23
394.2089233	0.05
395.1802979	0.02
399.3169556	0.04
407.2326660	0.07
411.0799561	100.00
412.1196289	12.57
418.5250244	0.02
419.5515747	0.02
421.2427368	0.07
426.2431641	0.03
427.3109131	0.05
431.4000854	0.18
434.3626099	0.02
442.2959595	0.03
443.1259155	0.02
460.2738037	0.04
464.9510498	0.03
474.4127808	0.01
475.8564453	0.16
476.9483032	0.03
482.3103638	0.07
483.8870850	1.27
485.0723267	0.03
491.3338623	0.04
500.5679321	0.04
502.3529663	0.05
503.3713989	0.80
504.4331665	0.01
505.6079102	0.17
510.2354126	0.11
511.2359009	0.05
512.2360229	0.42
513.0730591	0.03
530.2416382	0.49
531.4025269	0.24
548.1736450	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	424.1701
Annotation	Unknow
Peak:m/z	Relative Intensity
120.0018082	1.46
148.2847290	0.06
154.1556396	0.28
163.8430328	0.10
166.0785828	14.77
181.1685486	0.14
185.9548035	0.37
213.3691406	0.21
232.1187744	1.31
241.2468262	0.65
243.3562012	0.06
244.9779053	0.15
249.0537415	0.43
259.3177795	0.71
277.1573486	1.43
278.1733398	1.52
283.2657471	0.43
284.1089172	0.16
291.0332642	0.07
295.1461792	100.00
295.7583313	0.29
303.4113770	0.21
345.6708679	0.64
361.0578003	0.17
377.4667053	0.08
378.2895508	0.09
379.2806396	0.17
387.9955444	0.81
392.2608643	0.28
405.6839905	0.73
406.4657288	1.24
407.2731018	0.85
425.9050293	0.06
434.1921387	0.37
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
86.0051270	0.47
87.0655289	0.26
97.0628815	0.11
111.2403870	0.04
113.1042175	0.11
126.0187073	0.04
127.9811249	100.00
128.9853058	29.96
130.0417175	8.76
153.1603699	2.27
154.1229248	0.46
155.1550903	0.29
160.0334320	0.37
161.0584412	0.63
162.1020508	1.40
171.0741119	12.17
172.1195221	6.19
173.1021118	3.31
179.1022034	1.69
180.2106018	0.19
192.1327362	0.05
194.3118591	0.07
197.0138092	0.85
197.9021149	0.78
199.0428467	0.06
201.1758728	0.11
215.1022644	12.66
216.0700989	5.24
217.0779419	2.56
219.3590698	0.15
229.0640869	0.10
231.2133484	0.09
247.1947937	0.05
254.0830078	0.92
255.0895691	3.42
271.2674561	0.51
272.1455688	13.53
273.1084595	16.54
276.0693359	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.1145
Annotation	D-Galactofuranose
Peak:m/z	Relative Intensity
115.8745193	0.06
136.0944366	0.10
180.1098633	0.08
197.2477722	0.11
216.3168640	0.10
224.9789734	0.12
256.9814758	0.12
271.3749695	0.15
288.0488281	0.24
289.2476196	2.68
296.9035034	0.55
304.1243286	0.04
305.1737061	0.08
307.2466431	0.43
323.0647278	0.07
327.1650391	0.23
341.2595825	100.00
368.1972351	0.06
369.2444458	0.80
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	209.0668
Annotation	Sedoheptulose
Peak:m/z	Relative Intensity
69.0703659	0.58
70.9770966	1.65
82.9908447	1.74
84.9059296	10.03
86.9727936	12.03
88.9527130	0.92
96.8584137	2.86
98.9319458	4.07
100.9486237	0.10
111.0103455	10.21
113.1294098	0.38
114.9018250	2.69
119.0505371	0.14
129.0016632	100.00
131.1056671	0.31
132.9874115	0.52
135.2595673	0.09
140.9456329	7.28
142.9568024	0.09
144.9469147	0.28
145.7922668	0.07
147.2011566	0.19
158.9246521	43.30
162.8393097	0.66
164.9892731	0.85
173.1872406	0.22
177.2693634	0.61
191.0418854	2.35
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	381.0781
Annotation	Unknow
Peak:m/z	Relative Intensity
125.2803497	0.20
144.0836639	0.09
144.9736938	0.11
147.2203064	0.79
148.0454407	0.78
151.2353363	0.17
162.2274170	0.15
166.3774261	0.20
177.1472931	0.24
182.0714264	0.22
187.1331329	0.17
198.3323975	0.09
201.0337067	5.63
209.2261810	0.13
213.0397034	0.27
214.7591705	0.20
215.9899902	4.70
216.9382477	0.43
219.0321960	5.07
228.1394958	0.14
233.9705200	17.27
235.0126648	2.93
244.0158081	0.09
247.0234375	0.42
249.0848694	0.35
251.0662537	100.00
252.1432495	19.48
260.9327393	0.13
263.0246887	0.15
264.9768677	0.38
274.9266052	0.09
276.8454895	0.20
287.0177002	0.12
289.8243103	0.18
290.5223083	0.52
291.1867065	0.67
291.9769287	0.17
305.1647034	3.62
306.2112122	1.57
308.1075439	0.35
310.3313599	0.27
316.8930054	0.16
319.0488892	0.18
335.1281128	0.55
336.1859436	0.15
337.0202637	2.87
345.1215515	0.19
346.1957092	0.28
352.7164612	0.93
362.1408997	1.12
362.8704529	5.17
363.5119324	0.06
364.1267090	0.38
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	697.4507
Annotation	Unknow
Peak:m/z	Relative Intensity
332.2730103	0.33
349.2091675	15.49
350.2647095	0.17
523.1488037	100.00
524.2092896	2.47
539.4320068	0.20
543.5877686	0.59
551.1111450	0.14
594.7846680	0.15
614.4605103	0.22
615.9091187	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	463.0882
Annotation	6-Hydroxytricetin 5-rhamnoside
Peak:m/z	Relative Intensity
151.0218506	0.10
178.9549561	0.14
192.2647095	0.01
211.4198456	0.04
257.0853271	0.04
273.2700500	0.21
301.1040039	100.00
301.9338379	0.01
313.2947693	0.04
343.1871948	0.21
353.1376648	0.03
353.9271545	0.01
373.3344421	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	534.11
Annotation	Unknow
Peak:m/z	Relative Intensity
169.1586761	0.24
169.9906311	0.06
175.3134918	0.12
176.9714966	0.66
178.1383667	0.09
179.2861176	0.06
189.9900818	0.24
205.9553223	0.25
209.2210693	0.52
211.0709381	0.25
212.1186829	0.17
215.9407349	0.60
219.1067963	0.08
226.8229065	0.10
230.9913483	0.49
241.9059601	0.16
247.0582886	0.51
248.7302856	0.14
251.0769043	0.91
258.2845154	0.05
267.8964539	0.64
281.1200562	3.42
283.1128540	10.20
288.1656189	0.44
290.6670532	0.05
302.0164185	1.14
306.1489868	0.50
306.9711914	0.25
308.0253906	0.11
313.0829468	1.36
315.0429688	1.39
329.3602905	0.16
330.7520142	0.54
333.1206055	0.08
335.1055298	0.06
338.0786133	0.38
347.1538086	1.58
348.2090454	0.21
353.3965454	0.32
355.2609863	0.20
356.2336426	0.08
367.3795776	0.28
373.0717773	0.43
380.1763306	0.24
384.8450317	0.20
387.0321045	1.71
391.9834595	0.16
393.4572144	0.13
396.0671387	0.30
397.2336426	15.20
405.0916138	100.00
410.1467896	0.07
411.3923950	0.83
412.1062622	3.13
430.2894287	0.39
442.1826172	1.68
444.2217407	0.99
447.3242188	0.06
450.2524414	0.08
454.1325684	0.16
459.1679077	3.71
460.0256348	0.38
473.3720093	0.05
485.9790649	0.04
499.6724243	0.10
502.3268433	1.47
503.9674072	0.14
505.2563477	0.34
511.8648071	0.28
516.0370483	12.02
516.6804810	0.08
519.4636841	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	396.12
Annotation	Unknow
Peak:m/z	Relative Intensity
117.9932556	0.32
129.0823975	0.18
132.0143127	0.02
143.9125977	0.32
145.0616913	0.48
146.0114441	0.39
146.7416687	0.05
161.9880981	1.83
163.1502380	1.76
164.1131592	1.30
171.9750977	0.38
172.7868652	0.42
173.8245239	0.34
198.5915222	0.05
215.2563629	0.06
229.4101868	0.40
230.0472107	1.73
231.0476685	3.62
231.9867249	3.70
232.7682190	0.06
236.2666626	0.10
247.3843689	1.43
248.0834656	7.90
249.0154724	10.85
250.0253601	9.05
254.2164917	0.25
254.8313293	0.05
256.1386719	0.07
265.1156006	54.82
266.1253662	100.00
267.1251221	85.72
267.7381287	0.27
276.2169189	0.30
277.1200562	0.08
290.5864258	0.06
291.2180176	0.07
292.2770996	0.28
297.2701416	0.04
302.2893677	0.24
302.9757690	0.47
306.0065918	0.38
314.7200623	0.04
319.1778259	1.70
320.2476196	4.73
321.2164001	2.37
331.4763184	0.26
332.2346802	0.35
333.0697632	0.36
335.9624939	0.06
338.1136780	0.12
342.3667908	0.05
351.9480286	0.14
355.5905762	0.07
359.2540283	0.28
360.2963562	0.03
367.5528259	0.03
377.2120056	1.44
378.2485657	1.88
379.2907715	0.34
386.7427063	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	665.2151
Annotation	Lychnose
Peak:m/z	Relative Intensity
215.1555786	0.11
219.1432800	0.47
221.1492615	1.15
245.0460510	0.10
250.8009644	0.81
275.0383606	0.05
280.7401123	0.28
287.2949219	0.06
292.5731812	0.08
305.2069092	0.34
323.1423340	4.00
341.1915894	11.41
359.3007812	0.04
371.3273926	0.12
381.3025513	0.16
383.3132935	100.00
395.2231445	0.69
407.3591309	0.94
425.1356812	0.17
439.2553711	0.14
443.0725708	4.04
467.4180908	0.04
484.2050781	0.26
485.3142090	8.07
490.0587158	0.15
503.3136597	14.63
504.3156738	0.04
545.4164429	0.25
577.5628662	0.21
617.7977905	0.18
647.6292114	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	335.0918
Annotation	Musanolone D
Peak:m/z	Relative Intensity
118.9837341	3.71
119.9868317	8.59
128.0183411	36.70
129.1200562	0.15
141.0448151	0.07
146.2367554	0.16
153.1157837	2.69
171.1129913	3.46
173.1354065	0.15
175.1335449	0.17
179.1110687	7.79
187.3047028	0.08
197.1132050	18.42
201.1358795	0.16
206.1208801	100.00
213.3420410	0.13
215.0960388	30.21
219.2001953	0.16
225.3859863	0.08
231.1431274	5.61
249.0789795	41.38
257.1373291	0.46
265.1875916	0.10
271.4968872	0.18
283.3083191	0.28
289.1997070	0.49
291.3963623	0.10
298.7510681	0.36
307.3648071	0.08
317.1447144	64.99
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	380.1111
Annotation	S-Lactoylglutathione
Peak:m/z	Relative Intensity
112.1096115	0.02
130.0481720	0.28
131.0070190	0.05
143.9456787	0.24
147.9537659	0.97
158.1290894	0.06
182.0191803	0.06
198.2050171	0.03
199.2126007	0.05
204.9733429	0.03
206.1358490	0.04
216.0411072	4.61
233.4002686	1.73
234.0349731	13.62
249.0330200	0.21
251.0644226	100.00
256.2325134	0.04
274.1036377	0.04
276.6311951	0.49
287.1719971	0.24
288.9631653	0.03
295.8646240	0.03
305.1694336	4.87
317.1328430	0.35
334.0456543	0.15
344.2964478	0.20
362.2781067	0.96
363.2656555	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	587.2354
Annotation	L-gamma-Glutamyl-beta-phenyl-beta-L-alanine
Peak:m/z	Relative Intensity
163.9558105	0.00
165.5156860	0.00
171.3623352	0.03
172.1466980	0.01
185.2369080	0.04
186.2022858	0.01
213.3038025	0.28
214.2508698	0.09
231.2959290	0.08
232.1081696	0.01
249.2424927	0.02
257.3308716	2.19
258.3404541	0.17
275.2833557	8.75
276.3973389	0.54
293.2046204	100.00
294.1900635	5.12
295.0043030	0.00
338.2215576	0.01
421.7142944	0.01
471.6477661	0.01
482.4460449	0.00
499.3538208	0.02
507.3246460	0.02
541.4015503	0.01
568.4603271	0.04
569.1583862	0.01
569.9752808	0.01
570.7345581	0.00
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
127.9668121	100.00
130.0675354	2.22
171.0866852	0.03
214.9530640	0.04
223.2155151	9.44
241.2299957	35.56
280.0479736	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	355.03
Annotation	Unknow
Peak:m/z	Relative Intensity
108.0442810	0.09
175.8811035	0.14
177.9845428	0.61
193.1696167	0.19
208.3172455	0.26
216.9543762	0.85
223.0397034	0.28
225.2076111	0.17
234.9653625	0.08
236.9218140	0.11
247.0229797	0.55
253.3418884	0.13
256.3216553	0.21
264.4931335	1.34
265.1361389	2.59
267.1596985	0.56
268.3270569	0.48
271.3316650	0.28
272.9910278	0.31
274.0802612	0.54
275.1583862	0.16
277.1587219	0.36
279.9895325	3.05
294.4628906	0.31
295.0908203	6.51
297.5049133	0.25
307.0477295	0.49
309.3022461	0.40
313.8144226	0.27
319.1353760	2.60
323.2168274	0.10
325.2673035	0.32
327.1964722	0.28
331.9825745	0.18
337.1109009	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	388.02
Annotation	Benzylhydrochlorothiazide
Peak:m/z	Relative Intensity
114.9643478	0.27
126.8235092	0.35
133.9926147	0.70
150.9893951	0.25
155.0655518	0.79
160.0821838	0.35
171.2589722	1.14
175.0614929	0.33
184.8911133	0.66
192.0682068	4.27
205.1030884	0.27
219.2986755	0.35
221.2961121	0.19
223.9772339	3.50
227.9851074	0.31
235.0770874	0.39
236.9609070	0.42
239.2354431	0.35
254.8047485	1.03
257.9648743	1.51
261.2091064	0.63
266.5681458	2.75
267.1806946	1.50
270.8330078	0.48
273.9968872	0.64
281.1490479	0.47
285.5840454	0.29
294.0566406	0.21
295.2746277	0.44
298.1901855	1.32
304.1008301	0.16
309.1826477	0.33
310.9954529	0.66
313.3139648	1.33
316.0195923	0.39
329.8572998	1.69
338.9339600	0.70
339.5428467	0.25
342.4392090	1.26
347.3709106	0.46
348.2364502	1.16
351.5177917	0.54
353.2970276	0.50
355.9344177	0.55
356.8570862	0.77
370.0831604	100.00
371.1166077	3.68
371.8193054	1.37
378.5018311	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	402.9171
Annotation	Unknow
Peak:m/z	Relative Intensity
130.9616394	0.03
147.2380219	0.02
159.0447693	0.15
159.9350128	0.04
175.0193481	0.74
176.2595215	0.01
228.8673401	0.01
245.1465759	0.06
246.0868530	0.02
273.0715942	2.97
274.0966797	1.13
287.1356812	0.08
288.9999390	100.00
290.0458984	15.07
314.3572083	0.02
319.0833435	0.01
329.1062317	0.06
334.6593018	0.02
345.1387939	0.01
346.8707275	0.03
347.8583984	0.05
357.0558777	0.09
358.2092590	0.11
359.1651917	0.04
375.8443298	0.05
385.1628113	0.03
404.1367493	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	961.0651
Annotation	Unknow
Peak:m/z	Relative Intensity
453.0560303	1.05
619.0529175	1.42
943.1306763	0.35
958.4376831	0.26
1503.9407960	1.98
1539.8585210	0.16
1563.0480960	0.22
1583.1350100	0.29
1656.4763180	0.26
1657.5578610	2.23
1658.3444820	0.52
1664.1047360	0.41
1701.8211670	0.28
1703.1130370	0.16
1730.3728030	0.65
1734.8006590	0.33
1759.4007570	0.24
1762.8182370	0.22
1769.4421390	3.32
1771.3181150	0.17
1804.5294190	5.59
1807.4468990	1.58
1811.5148930	0.54
1815.5438230	0.16
1816.2624510	0.33
1817.7751460	0.13
1819.9294430	0.16
1821.5944820	1.86
1822.5037840	0.26
1828.7897950	0.29
1833.1119380	0.62
1836.7525630	0.70
1840.6754150	1.27
1844.4351810	1.01
1846.3843990	0.67
1847.9793700	0.26
1850.7303470	1.88
1851.6429440	0.31
1852.3009030	5.79
1854.2629390	0.79
1856.8914790	1.28
1860.8988040	0.71
1867.7860110	1.14
1869.0826420	1.22
1873.2907710	0.29
1876.4461670	0.52
1877.7463380	0.64
1878.6368410	0.26
1880.1937260	0.66
1881.5466310	0.46
1884.2136230	1.48
1884.9748540	0.67
1886.2052000	1.28
1886.8684080	16.56
1887.7623290	0.24
1891.8336180	0.28
1892.9639890	0.57
1894.4494630	3.25
1895.3176270	1.32
1896.8050540	0.46
1898.2677000	0.43
1901.1003420	0.55
1901.8499760	0.45
1906.3565670	2.02
1907.3790280	0.65
1908.2581790	0.54
1910.1114500	1.31
1911.0828860	0.39
1913.2214360	0.36
1914.7552490	2.20
1915.5289310	0.31
1916.7061770	2.53
1918.2399900	13.22
1919.2554930	0.58
1920.1673580	4.11
1920.9268800	0.20
1923.8304440	0.30
1925.2845460	0.56
1927.9167480	100.00
1928.8669430	0.75
1930.0499270	0.97
1931.2677000	0.30
1931.9772950	15.18
1935.9815670	1.46
1937.1854250	8.21
1938.6717530	11.46
1940.6853030	18.48
1942.3458250	6.50
1943.0972900	0.10
1943.9105220	1.98
1945.9798580	1.92
1947.4483640	0.52
1949.1807860	39.34
1950.4561770	7.18
1951.7341310	5.91
1952.9890140	0.69
1954.1417240	27.42
1954.9141850	0.36
1956.0186770	2.70
1957.7857670	0.22
1958.5477290	2.40
1959.5354000	35.29
1960.5886230	2.81
1961.3494870	9.10
1962.6488040	0.41
1964.2884520	1.24
1965.1151120	0.58
1966.6185300	4.43
1967.6823730	0.14
1969.0524900	0.24
1970.1373290	0.86
1971.6506350	9.26
1972.3912350	0.39
1973.0323490	3.83
1973.8355710	1.04
1975.9002690	2.52
1976.5623780	1.40
1977.3264160	0.37
1978.2403560	2.28
1978.8840330	1.49
1980.0860600	14.90
1981.5096440	20.21
1982.6007080	1.04
1983.5827640	4.99
1984.2425540	0.24
1986.4608150	1.59
1987.1365970	1.17
1987.9586180	0.56
1989.6890870	12.51
1990.9432370	2.18
1991.6160890	0.35
1992.2375490	5.16
1994.4664310	0.98
1995.0964360	1.48
1995.7247310	11.63
1997.0192870	0.54
1998.3233640	1.33
1999.2342530	2.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1233.4758
Annotation	Unknow
Peak:m/z	Relative Intensity
795.3231812	0.15
806.3856201	0.44
1071.9154050	0.86
1085.9569090	0.14
1470.9525150	0.20
1653.4761960	0.12
1687.0351560	0.19
1705.1213380	0.34
1726.2398680	0.11
1745.2725830	0.18
1746.1468510	0.60
1747.4522710	0.28
1748.0848390	0.68
1759.3282470	0.15
1762.4738770	0.16
1767.7146000	3.73
1771.9880370	2.79
1776.7521970	0.18
1777.3742680	0.33
1779.6563720	0.35
1783.9342040	1.14
1787.5980220	0.19
1796.2883300	0.46
1814.3687740	0.12
1818.7336430	0.46
1820.6234130	0.20
1825.5240480	0.17
1827.5891110	0.47
1831.9954830	3.42
1833.5085450	0.71
1835.5731200	0.22
1837.2805180	2.58
1841.3573000	0.19
1845.5430910	0.14
1850.2335210	2.74
1853.7930910	0.91
1855.1497800	0.11
1858.5103760	1.31
1859.1612550	0.19
1864.9046630	2.26
1868.6251220	0.23
1874.2135010	0.31
1875.4071040	0.29
1878.4406740	1.59
1882.7281490	0.11
1887.8731690	0.64
1893.0343020	0.38
1896.1091310	1.47
1899.4034420	0.66
1900.9466550	0.46
1903.9620360	0.25
1904.6848140	0.10
1906.1481930	0.48
1908.4278560	0.45
1909.3648680	0.19
1910.1995850	0.14
1911.8428960	6.96
1913.3585210	1.87
1914.3479000	0.43
1915.6917720	0.24
1917.3439940	0.11
1918.3582760	1.38
1923.1145020	0.88
1925.6837160	1.38
1926.3791500	0.79
1927.4888920	0.16
1928.1324460	0.66
1929.1195070	0.08
1930.4100340	4.02
1931.4328610	0.25
1932.4429930	0.38
1935.5397950	0.17
1936.7113040	1.46
1941.3806150	2.32
1942.6595460	7.83
1945.6165770	0.54
1946.3287350	0.22
1948.2083740	0.16
1951.7552490	1.10
1954.6280520	0.18
1955.3380130	7.10
1956.2742920	0.20
1957.4534910	0.78
1962.4543460	0.18
1965.0201420	0.43
1966.1368410	1.28
1967.0330810	2.02
1967.7847900	0.40
1968.4978030	9.78
1969.5207520	0.40
1971.1568600	0.46
1971.7803960	4.01
1972.8192140	2.02
1975.2220460	3.09
1978.2722170	0.46
1979.4180910	16.70
1980.5422360	0.17
1981.7869870	1.69
1982.4820560	1.84
1984.0944820	2.13
1987.4686280	100.00
1988.7239990	17.50
1989.7863770	21.35
1991.5618900	15.73
1992.2928470	0.12
1994.0242920	46.09
1995.7188720	1.60
1996.7398680	33.14
1997.3992920	1.48
1998.6218260	18.41
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	503.92
Annotation	Unknow
Peak:m/z	Relative Intensity
158.9837341	1.64
160.0528259	0.79
160.9917755	0.78
199.1287842	0.46
199.8802795	0.03
200.9063568	0.52
217.0374756	0.08
218.9765930	0.05
229.1059570	0.76
229.9479523	0.14
231.0509033	0.74
231.9397125	0.13
245.1851196	0.07
246.2986450	0.06
273.0211792	26.97
274.0576782	16.88
275.0491638	28.66
276.1248474	5.22
345.8455505	0.05
387.0130920	26.54
388.1618347	31.30
389.0309753	100.00
390.0021973	27.97
390.6122131	0.24
414.1047974	0.19
428.1786499	0.10
429.0747986	0.09
430.2411194	0.14
457.7142639	0.18
458.9906921	0.98
472.9441528	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	587.24
Annotation	L-gamma-Glutamyl-beta-phenyl-beta-L-alanine
Peak:m/z	Relative Intensity
185.2221222	0.02
213.3791199	0.42
214.4565887	0.01
231.0214233	0.15
257.1774292	3.31
275.2497559	10.32
286.2420654	0.02
293.1765137	100.00
304.2660522	0.01
305.3403320	0.02
306.3346252	0.02
324.3014526	0.02
568.3682861	0.03
569.5311279	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	516.1
Annotation	4beta-(2-Aminoethylthio)epicatechin 3-gallate
Peak:m/z	Relative Intensity
159.7378998	0.19
166.1067505	0.11
168.9736938	0.66
171.2733459	0.37
175.0073853	0.06
179.0986938	1.79
181.0820923	0.22
184.9939423	0.14
197.2100830	0.30
203.0744629	1.69
208.3291626	0.24
210.0788574	0.42
210.7583923	0.09
215.2906494	0.33
218.9577942	0.15
225.8260803	0.09
227.8761292	0.13
228.5155640	0.19
231.1045837	1.51
233.4049835	0.13
243.6306000	0.06
249.1003418	4.00
252.2289734	0.62
254.1610413	7.12
255.1389008	0.06
272.2310181	28.69
273.0814209	0.07
282.2355957	0.05
286.2330933	0.55
286.9649658	0.07
288.0778198	4.56
304.2842407	7.04
306.1450806	18.45
315.7192993	0.13
320.2017212	0.05
326.1404419	0.44
331.2694702	0.11
342.3477783	0.15
346.2643433	0.09
356.1369629	0.12
360.2128906	9.29
364.9501343	0.11
378.1420288	100.00
397.3963623	0.10
410.2100220	0.45
423.9797363	0.26
426.2760010	0.10
428.2321777	0.10
429.3726807	0.13
430.1932983	0.13
437.2773438	0.23
450.4023438	0.92
457.3853149	0.13
458.2490845	0.12
460.0372314	0.06
469.1761475	0.16
470.0590820	0.25
471.2673950	0.20
476.6134644	0.11
478.3530884	0.59
479.0994263	0.23
480.5097656	0.16
487.9334717	0.11
497.3429565	0.68
498.0696411	0.78
498.6958618	0.25
502.8751831	0.16
506.4310303	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	263.07
Annotation	N-Acetylcystathionine
Peak:m/z	Relative Intensity
85.9220734	0.10
127.9427948	100.00
134.0778656	1.36
143.1004639	0.15
153.0030365	1.87
171.0610962	1.93
176.0581055	0.04
179.0934906	0.33
197.0895386	2.00
201.1159515	0.35
202.2881927	0.10
215.0978546	6.82
227.0486603	4.61
227.6855164	0.05
243.8199310	0.02
245.0400391	40.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	580.2122
Annotation	Unknow
Peak:m/z	Relative Intensity
213.0837860	2.16
232.1212311	0.84
251.2304230	5.46
386.9287720	1.62
406.0408325	9.63
412.2022095	1.48
425.1157227	100.00
428.7202148	1.18
447.3088989	1.04
470.5750122	0.47
534.1781616	0.98
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
179.2022400	0.01
185.2063599	0.04
323.1390991	0.04
340.3764648	0.05
341.2012939	0.15
392.3079834	0.03
402.3858643	0.01
410.3857422	0.06
428.3608398	0.02
461.2709961	0.01
486.8978882	0.01
503.2959595	100.00
504.5090332	0.01
506.1355591	0.04
530.2651978	0.14
539.4048462	0.01
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
109.0300140	0.01
125.8790131	0.03
128.0378723	3.18
137.3797760	0.02
141.1345520	0.11
143.0591736	2.76
145.1875916	0.09
146.1557312	0.35
150.8863983	0.06
152.7243042	0.04
158.0741882	0.07
160.1442871	0.53
166.1582642	0.17
167.1892700	0.41
169.0934753	0.53
170.0605469	0.08
171.1411743	0.13
175.0024414	1.32
177.1464996	0.20
179.1362000	3.64
182.1921997	0.17
185.1377869	1.19
191.4754028	0.03
197.1135712	0.94
197.9807434	0.02
198.9006653	0.02
203.1853638	0.47
208.2794189	0.08
210.1290283	2.39
210.9326782	0.04
215.1855164	0.04
224.1741638	0.03
226.0831604	0.69
228.0890503	0.04
229.0531616	0.03
236.1297302	0.15
240.3306274	0.06
242.4290771	0.07
249.1981506	0.90
251.2347107	0.09
252.1809692	0.63
254.1381836	24.29
254.7621460	0.04
260.2385864	0.17
267.9832764	0.09
270.3424683	0.14
272.1589050	92.25
286.1708374	17.78
288.1324158	0.84
292.3326416	0.02
300.5091553	0.02
304.2118835	100.00
306.1318054	4.84
310.2007446	0.03
326.1610107	0.30
331.9750977	0.02
333.2052002	0.04
341.2550659	0.16
344.3385010	0.03
360.1887817	14.92
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	338.0485
Annotation	S-Sulfanylglutathione
Peak:m/z	Relative Intensity
120.1347275	0.04
125.0512848	0.08
128.0972748	0.11
137.0583649	0.02
143.1390076	0.42
144.9944153	0.10
146.1696167	0.02
156.9833069	0.04
158.1515808	0.04
171.0440369	0.01
179.1157684	0.18
183.0395355	0.08
197.1307373	0.15
209.0058899	0.27
210.3379211	0.03
228.1296082	0.08
232.3825989	0.02
235.2144470	0.02
239.4097290	0.02
246.4947510	0.05
248.1435547	0.03
249.2144775	0.04
250.7987061	0.02
254.2376709	5.52
257.1550903	0.53
262.9595642	0.52
266.1596375	0.02
272.1335144	100.00
273.1889038	0.07
273.8512878	0.09
275.3030701	0.03
278.0603943	0.15
279.1380005	0.02
286.3077698	0.05
291.2413940	0.29
292.0845337	0.24
293.5645752	0.08
294.2208862	0.09
297.0676880	0.04
300.3047791	0.01
301.0591736	0.03
302.1421509	0.21
304.1196289	21.25
306.9763794	0.08
310.0694885	0.14
318.4412537	0.02
320.0502930	1.73
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	277.09
Annotation	Methionyl-Glutamate
Peak:m/z	Relative Intensity
78.8522034	0.04
83.6003418	0.03
96.9853363	0.10
127.9580841	100.00
128.9049072	0.10
148.0803375	2.64
167.3030090	0.04
205.2854919	0.03
211.0890198	0.13
215.1285706	0.08
216.1450195	0.05
233.2699585	0.05
241.1203613	3.98
259.1020813	73.11
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
77.1356125	0.05
84.0664520	0.10
89.9561539	0.58
118.9817200	71.85
130.0194397	0.93
135.8973846	100.00
143.6844177	0.13
147.1332703	0.05
148.1541595	0.11
157.0646973	0.07
171.8842773	0.19
202.0258636	1.71
217.2317963	0.05
218.9164886	0.41
229.9930725	1.63
247.1703339	3.35
248.1204224	13.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	298.2734
Annotation	Dehydrophytosphingosine
Peak:m/z	Relative Intensity
94.9666138	0.06
97.0381927	0.03
107.2242126	0.07
109.0281067	0.07
121.0064392	0.15
133.1022491	0.17
137.0215149	0.86
151.0840302	0.17
155.2288208	0.05
161.1376038	0.39
163.1200409	0.14
165.4084625	0.05
170.0270386	0.09
171.0294189	0.03
175.0297241	0.03
177.2699890	0.05
184.0350037	0.11
188.8924408	0.03
195.2735291	0.12
199.3851624	0.05
212.5475159	0.07
217.1735229	0.17
221.0331726	0.08
225.3067627	0.06
228.2571411	0.06
237.4436035	0.05
240.1734619	0.02
241.4644470	0.07
242.3653564	1.19
243.5275879	0.06
245.2820129	0.93
248.3731079	0.02
252.3433228	0.55
256.2241821	0.15
257.2128296	0.04
263.2132568	35.83
263.8451233	0.14
269.4905090	0.14
270.1798401	0.19
280.3074341	100.00
280.9385986	0.26
281.5582275	0.14
288.6359863	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	277.1065
Annotation	Minumicrolin
Peak:m/z	Relative Intensity
106.8799133	1.12
109.2180634	0.08
114.1059418	0.07
118.9861221	0.04
121.0343552	0.05
122.9837341	0.10
124.0895844	0.08
150.1201782	0.13
152.4770203	0.23
153.2973022	0.11
160.9704285	0.06
167.0481262	0.10
170.9646149	8.58
171.6013489	0.05
175.2156677	0.05
177.2176971	0.09
182.1234741	0.20
186.2344208	0.12
189.1343231	0.22
191.2922363	0.04
193.2962646	0.16
194.9947205	0.06
196.2297363	0.06
203.0602417	0.11
204.9912720	0.27
217.0353699	0.30
221.2879028	0.23
222.9439087	0.22
228.4537659	0.12
229.2948914	0.05
231.1187744	0.75
232.2049561	0.11
235.2031555	7.04
241.2079773	0.96
242.8675537	0.30
248.1264038	0.26
249.1618347	0.16
253.9983521	0.04
255.9844971	0.05
259.0214844	100.00
260.4721069	0.05
267.2045898	0.26
268.0662842	0.11
271.0106201	0.11
276.2306213	0.21
277.2700806	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	695.1366
Annotation	Unknow
Peak:m/z	Relative Intensity
211.1337891	0.20
231.3665619	0.32
284.1016846	0.09
301.1931152	20.20
302.4236450	0.19
303.3942261	0.06
305.1850586	0.07
307.3537903	0.05
394.1979370	0.14
427.2828979	0.18
439.3879395	0.05
440.3902588	0.06
463.2736816	100.00
464.2579956	0.51
465.3876953	0.86
466.3222656	0.75
517.1698608	0.22
533.1764526	0.25
535.1935425	0.05
543.4854126	0.13
547.4246826	0.04
560.4291382	0.10
573.2302246	0.32
594.9843750	0.05
599.2163696	0.21
601.6602173	0.08
602.4070435	0.05
603.2607422	0.23
604.3662720	0.13
605.3121948	0.26
606.1307373	0.13
633.3029175	0.05
636.2009277	0.09
649.4484863	0.24
659.6105957	0.26
676.6678467	0.33
677.4584351	0.20
927.0221558	89.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	555.123
Annotation	C.I. Acid Green 50
Peak:m/z	Relative Intensity
176.7080841	0.06
188.0213013	0.09
189.2133636	0.13
209.0902100	0.04
261.4727783	0.12
273.0401917	0.10
273.9605103	0.05
280.0010986	0.24
291.5191040	0.08
298.3144531	0.07
300.4450684	0.06
315.2980957	0.12
331.0787354	0.22
337.1752930	0.16
339.2186890	0.39
352.1369629	0.46
369.3280029	0.06
377.5335083	0.32
392.4929810	0.48
393.5180664	0.13
396.3244629	0.11
406.3604736	0.11
407.3391724	0.50
408.3272705	0.85
409.1929321	3.77
415.4191284	0.16
416.3638916	0.17
426.1929321	100.00
429.3718872	0.08
448.8829346	0.17
474.0213013	0.22
478.7373657	0.47
489.7070312	0.22
492.0053101	0.27
508.9372559	0.12
531.1712646	0.06
534.1733398	0.09
537.2890625	3.21
545.2782593	0.38
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	633.0992
Annotation	Unknow
Peak:m/z	Relative Intensity
183.9909363	0.21
212.0184021	0.16
214.0389404	0.29
215.0389557	2.60
216.1214447	2.28
216.9754791	0.11
225.0581665	0.45
246.2950134	0.11
253.9660797	0.16
255.0322876	1.35
255.9753265	16.09
257.1925659	0.23
258.0707397	0.09
259.3189087	0.27
265.1179504	0.14
266.0883179	0.99
267.3348999	0.08
269.0389099	1.41
270.1410522	0.17
289.1847534	0.21
290.1399536	0.38
298.2526245	0.41
299.2745361	0.17
302.1010742	0.78
302.9108276	0.37
304.4226685	0.19
308.1118774	0.39
310.0404663	4.79
311.1039429	4.99
312.0178223	0.32
325.9683838	0.07
335.1643677	0.41
336.3503418	0.43
337.2728271	0.17
341.2132568	1.03
342.1544189	10.38
343.1086426	100.00
344.1033936	5.96
344.7214966	0.22
345.3464966	0.25
354.1193237	1.66
355.1386719	0.12
372.1656494	0.08
373.1335449	0.16
374.0493774	0.25
376.0516357	2.66
377.1507568	0.39
379.2199707	0.07
383.2522583	0.13
384.4042969	0.39
385.0997925	0.90
386.2406616	0.66
387.0438843	0.04
398.3016968	0.09
399.2469482	0.16
409.1397095	0.24
410.3217163	0.18
413.0510254	0.10
415.2211914	0.07
416.1361084	0.22
416.9927368	1.26
427.1813354	0.19
428.2794800	1.02
428.9928589	0.40
429.9862671	0.16
443.0902100	0.09
453.0571899	1.07
454.2473145	0.52
459.2397461	0.10
460.2272339	0.05
471.0737915	12.68
472.1334839	2.82
479.2105713	0.04
484.6661377	0.35
486.4121704	0.13
487.4035645	0.04
488.0925293	0.22
496.0610352	0.31
497.1475220	10.88
498.1589966	2.30
503.0872192	6.97
504.0728149	1.28
507.3042603	0.14
515.0808105	3.85
516.1902466	0.75
522.9414673	0.22
528.4807739	0.05
540.5407715	1.05
544.7238770	0.22
546.1600952	1.34
547.2236938	0.28
558.1599731	0.69
559.1242676	0.96
588.2062378	0.87
589.3052979	0.33
596.0343628	0.21
597.2726440	0.63
611.9902344	0.09
614.0037842	9.64
615.2020874	12.77
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
115.9560699	0.17
130.1739807	0.08
142.1154175	0.84
153.9179535	0.05
157.2721100	0.06
159.1720428	0.97
186.1884155	0.18
203.0626221	100.00
204.0544434	0.21
245.1387939	0.16
249.2484741	0.04
364.1446533	0.04
371.2778625	0.04
388.4140930	0.27
389.4085388	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	394.11
Annotation	Unknow
Peak:m/z	Relative Intensity
112.1674957	0.09
127.9808273	4.88
128.9927673	1.43
129.8142395	0.16
134.9846802	0.78
135.9355621	0.05
142.9448242	7.96
144.1163330	2.87
145.1094055	0.87
146.1329803	0.49
146.9901123	0.54
153.2192993	0.06
154.2073364	0.05
155.0676270	0.15
160.1723022	0.12
162.1651001	0.05
166.2891846	0.39
167.1111450	0.38
168.1162720	0.97
170.1115265	0.62
170.9090881	0.60
172.0234070	0.37
177.0404053	0.21
179.0167236	11.34
180.0827637	5.26
181.1975861	0.86
183.1121216	0.39
185.0694580	0.28
186.9728699	0.09
192.1110992	0.33
196.0947571	0.05
197.2998657	0.38
198.2119904	1.05
199.1647797	0.05
208.0789948	0.07
210.1599274	7.13
211.2203979	2.93
212.2369690	0.61
215.3032532	0.07
228.1202698	0.07
229.2010193	0.14
230.4081726	0.08
236.0659790	0.15
237.2949524	0.48
242.1209717	0.32
245.9719849	0.06
254.1678772	79.92
255.1355286	77.01
256.1986694	12.76
263.0516663	4.22
264.1548462	7.57
265.2503967	3.82
272.1640015	100.00
273.1511536	98.34
274.2326050	20.77
288.3804626	2.34
289.1784668	5.35
290.2009888	4.40
304.0377808	0.06
306.1828613	19.30
307.1235046	50.28
308.2657166	30.99
317.3196411	0.14
357.4680481	0.17
359.1788940	0.32
375.1698303	32.44
376.2373962	15.74
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	523.1686
Annotation	Unknow
Peak:m/z	Relative Intensity
162.0579834	2.75
162.9186401	0.18
171.9443359	0.42
173.0043945	0.54
193.4025879	0.08
195.1990967	0.22
208.1270142	0.16
229.9367981	6.96
230.8714294	1.14
241.1441040	1.41
242.2307281	0.12
247.0054932	3.50
248.0026550	8.25
249.0983887	1.81
256.5738831	0.15
259.2126465	0.52
260.1212158	0.11
265.1308594	66.75
266.1952515	13.34
267.3305054	0.13
273.6101074	1.62
274.2371521	2.34
275.2523804	0.96
282.1969604	0.59
291.0939941	2.03
292.0457153	1.07
293.0064697	0.67
301.2662964	0.11
310.1804199	1.97
311.3162842	0.31
314.3926392	0.12
315.2653809	0.36
319.2592163	12.04
320.3040161	1.50
328.4404297	0.10
331.2262573	2.02
332.4763184	0.51
367.2770996	0.34
368.3391113	0.08
376.2349243	2.07
377.1840210	0.84
378.4675903	0.07
384.6643677	0.81
385.4089355	0.60
387.1843872	0.14
394.1757812	100.00
395.2571411	28.74
403.3805542	0.44
417.3128052	0.07
418.4501343	0.46
430.2020874	3.51
431.1915283	0.43
434.3372803	0.09
442.7747803	0.34
448.3309326	7.01
449.1845703	1.95
460.2976685	0.43
461.1457520	0.40
463.7677612	0.70
465.4822998	0.21
478.0514526	0.50
488.8638306	0.34
503.2094116	0.14
505.3291016	3.49
506.3937378	2.52
507.3189087	0.67
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	787.2436
Annotation	(gamma-Glutamyl-gamma-glutamyl)-S-methylcysteine
Peak:m/z	Relative Intensity
208.4000244	0.03
227.0334778	0.20
230.0404816	2.16
247.0139313	0.21
248.0634460	2.51
265.1116028	13.37
266.5474854	0.05
273.1843262	0.10
283.1472778	0.14
301.1840820	0.21
319.1284180	1.64
331.2971802	0.20
359.3868408	0.15
376.2249756	0.19
377.4749146	0.31
394.2341309	100.00
395.1704102	0.09
528.0459595	0.06
579.9537964	0.09
657.8760986	0.21
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
100.0491409	0.11
109.1280289	0.79
112.7028656	0.08
115.9045258	0.14
121.0944061	0.52
122.3261337	0.84
123.1967621	0.77
131.2404175	0.33
135.1040344	0.61
136.0899353	0.59
136.9201965	0.19
140.2050476	0.24
143.0503998	0.44
146.1314697	0.30
147.1193542	1.36
148.0040894	0.22
149.2119141	0.20
153.9920044	0.17
157.0950928	0.16
158.238678	0.47
159.2085876	0.64
161.0922852	0.18
162.1330414	0.65
165.0898132	0.27
167.1882172	0.10
168.5371094	0.17
169.319046	0.11
173.1504822	0.19
174.0932007	0.21
175.0122375	0.14
176.7585297	0.16
178.5131073	0.20
179.2309723	0.19
182.7829895	0.09
184.4874115	0.22
188.287323	0.11
189.2277069	0.41
193.0737915	0.89
193.9083405	0.14
198.8044891	0.20
201.1936035	0.44
203.1174774	0.13
205.1387939	0.69
206.4267426	0.31
207.1090698	0.61
207.8690643	0.13
211.0519714	0.34
212.0635681	0.15
214.0483398	0.11
215.1408386	0.39
216.4043274	0.17
217.1139221	0.43
219.0242004	0.39
225.3562622	0.11
225.9738159	0.08
228.0567627	0.25
229.215332	0.55
230.0591125	0.61
231.264801	0.52
236.1551819	0.38
240.1697083	0.67
241.1315002	0.29
243.1836243	0.46
244.4962158	0.09
246.0972595	0.44
247.1108704	1.00
248.147522	0.46
249.9049988	0.38
251.8475952	0.11
255.2130737	0.35
257.022522	0.71
258.4498596	0.22
259.2304077	0.23
261.1058044	0.74
263.3695679	0.45
264.1409912	0.12
268.2756042	0.76
271.3943481	1.83
275.2677002	0.95
277.3444214	0.67
278.3981934	0.18
279.1452026	0.21
280.7077332	0.57
282.3346558	0.36
283.1060791	0.13
284.0391235	0.15
285.6269531	0.26
289.1867981	12.03
289.8479004	0.14
293.1885376	8.21
295.3016357	0.56
296.3123169	0.70
297.2876587	0.47
298.7115784	0.68
300.2938232	0.71
301.3764648	0.79
305.0973816	0.83
306.3548889	19.99
307.3814087	1.41
311.2235107	2.93
312.3970947	0.30
313.7544861	1.14
314.4606018	1.00
322.4671021	0.09
323.5848999	22.93
324.2975159	100.00
325.273407	1.86
328.221344	0.11
332.8378601	0.79
342.680481	0.38
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	534.051
Annotation	Unknow
Peak:m/z	Relative Intensity
177.1627808	0.19
188.0804749	0.17
208.9924927	0.10
215.8653412	0.03
219.1420898	0.26
225.9025879	0.07
226.9066162	0.36
231.0881348	0.27
242.0553131	0.10
247.2153320	0.88
248.1734924	0.04
249.1618042	0.21
251.0316315	1.14
256.1559143	0.08
261.1676636	0.09
263.1693115	0.15
275.3069153	0.05
281.0654602	2.29
283.1344604	12.56
288.0206299	0.04
291.0049744	0.03
298.3231812	0.03
302.1160278	0.95
306.1415405	0.22
313.1149292	0.83
314.9710693	2.47
325.4838867	0.04
330.9450073	0.47
338.1524658	0.48
339.1609497	0.05
347.1634521	3.11
348.9660645	0.19
352.2847290	0.06
352.9479980	0.30
354.3631592	0.08
356.3388062	0.03
367.0435181	0.19
370.6808472	0.07
378.9606934	0.10
380.2669067	0.34
387.0128174	1.56
392.1475830	0.06
394.2183838	0.38
396.2272949	0.06
398.1974487	0.05
405.0390625	100.00
405.6782837	0.40
410.2143555	0.14
412.0322266	2.75
412.7673950	0.02
413.3796997	0.10
441.3009644	0.18
442.1325684	0.60
443.1517334	0.17
444.2086182	1.26
459.1079102	6.70
460.0416260	0.08
472.3592529	0.18
476.2231445	0.21
487.6041870	0.29
498.3956299	0.51
502.3759155	0.06
503.5558472	0.09
505.2068481	0.03
505.8811035	0.08
516.0496216	7.33
517.3645630	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	385.0423
Annotation	Unknow
Peak:m/z	Relative Intensity
121.9047546	0.15
140.4934692	0.21
146.9660187	0.67
212.9791260	0.12
223.0947876	2.22
225.5507812	0.16
233.1091003	0.32
233.9923706	0.28
237.4597778	1.13
246.9702759	0.10
257.0862732	0.15
259.1422729	0.76
264.5953369	2.48
265.2259521	3.37
267.9455872	0.53
271.2794800	0.26
277.0822449	8.97
283.3317261	0.86
286.2594604	0.37
289.1026001	0.17
293.5089722	0.25
294.8360291	21.09
295.5270691	0.12
300.5135803	0.15
301.2038574	0.17
303.7695312	0.16
305.0878296	2.89
306.9821167	5.05
309.9816284	6.12
313.4493408	0.93
321.0201416	0.63
324.8387451	36.13
325.5138245	0.12
326.6975098	0.64
327.4918823	0.46
336.6568909	0.57
346.2344971	0.68
348.8781128	1.13
355.1450500	0.96
367.1189270	100.00
375.3564148	1.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	332.125
Annotation	Tryptophyl-Glutamate
Peak:m/z	Relative Intensity
116.1544800	0.07
125.8518524	0.04
127.9800262	100.00
159.1124573	0.11
167.0525818	2.08
201.2620544	0.07
203.1369324	3.60
209.3327637	0.11
236.6505127	0.07
241.1841431	0.14
242.0461731	0.24
285.6444092	0.05
286.4062195	0.04
287.3441772	0.05
288.4515381	0.04
314.1944275	60.94
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1016.3333
Annotation	Unknow
Peak:m/z	Relative Intensity
775.2677002	0.30
780.5970459	0.39
800.0496826	0.60
1211.1610110	0.35
1526.5595700	0.39
1537.3768310	0.48
1555.0629880	0.19
1591.8190920	0.25
1602.0194090	0.70
1621.6549070	0.27
1640.3284910	0.23
1645.1812740	3.03
1651.7528080	1.21
1655.4729000	0.21
1681.4904790	0.25
1706.6048580	0.35
1715.7136230	0.23
1736.9874270	0.95
1744.1759030	0.31
1773.4381100	0.21
1794.8638920	0.27
1795.6760250	0.23
1811.7115480	0.20
1812.5916750	0.23
1820.6149900	1.42
1822.3049320	0.39
1824.4406740	5.42
1833.1422120	0.43
1835.7852780	0.39
1837.9415280	0.51
1840.3270260	8.18
1842.0363770	0.33
1843.3260500	1.18
1844.1690670	2.34
1844.9069820	0.39
1846.4455570	3.31
1850.5802000	0.31
1852.6394040	0.20
1855.3123780	0.21
1857.9666750	0.76
1858.9949950	1.16
1860.7127690	0.42
1862.1556400	0.57
1863.2056880	0.87
1869.6566160	0.27
1877.0684810	0.41
1879.0972900	1.47
1881.1942140	3.43
1884.0941160	0.41
1888.0142820	0.27
1894.5876460	3.66
1895.4056400	2.42
1900.5596920	0.73
1904.4128420	4.30
1905.8785400	0.20
1906.7414550	0.71
1907.3582760	0.24
1908.4146730	0.51
1909.4201660	1.02
1910.5333250	0.87
1913.7894290	0.75
1917.8284910	3.21
1918.7713620	0.29
1919.7313230	100.00
1920.7888180	0.31
1922.3796390	0.55
1923.7952880	1.04
1925.0448000	5.09
1927.0427250	0.92
1927.9807130	1.19
1929.2238770	0.24
1932.7176510	0.28
1933.5694580	0.80
1935.8361820	4.14
1937.4786380	2.62
1940.1975100	0.97
1940.8156740	0.39
1942.0758060	5.51
1942.8267820	2.62
1943.8322750	7.31
1944.8880620	19.37
1947.0021970	3.85
1951.1417240	21.15
1952.6691890	0.71
1955.2156980	1.98
1956.2672120	34.03
1956.9699710	0.82
1958.2376710	0.91
1959.1568600	7.92
1960.0128170	7.59
1961.5223390	8.28
1964.4519040	1.16
1967.3712160	0.42
1968.3406980	4.10
1969.7468260	10.34
1971.1387940	1.61
1971.7850340	0.24
1972.6829830	2.66
1973.3890380	0.65
1975.3903810	0.85
1977.2458500	24.96
1978.0406490	0.80
1979.5367430	25.43
1980.8375240	2.08
1982.7717290	5.39
1983.7512210	0.70
1985.7012940	0.36
1986.3825680	1.79
1987.0045170	0.87
1988.5596920	5.26
1989.2912600	1.08
1990.1195070	1.05
1991.5681150	2.13
1992.5850830	10.75
1993.4304200	18.20
1994.1160890	1.31
1995.1903080	10.64
1996.5661620	1.23
1997.3073730	0.21
1998.1446530	0.19
1999.9162600	0.59
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
98.0953674	0.03
116.1061401	1.42
127.9881897	100.00
128.9800110	0.03
159.5036774	0.03
172.9274750	0.06
183.1132965	0.04
197.1694489	0.07
201.0339355	0.02
203.1683350	0.03
209.0952454	6.90
215.1199493	0.06
217.2246552	0.04
227.1719818	30.98
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	387.0701
Annotation	Stictic acid
Peak:m/z	Relative Intensity
111.1926804	0.10
170.1046143	0.24
183.3141785	0.08
185.9520721	1.11
197.1204834	0.09
215.1185150	0.60
221.9652863	0.08
225.9946899	1.56
247.1218567	0.15
254.4451904	0.77
255.3235168	0.09
256.8359985	0.15
257.9495850	0.47
265.3238220	0.39
282.5394287	0.81
293.1198120	0.36
297.1768799	0.10
305.1051025	0.18
309.3475647	0.52
313.1362610	0.18
315.1415710	39.68
316.7521973	0.35
322.4365845	0.37
323.3244019	0.62
329.1822510	0.14
330.2086182	0.13
333.2022095	0.77
336.9378662	0.18
346.0324707	0.21
351.3661804	0.88
352.4736023	0.11
355.1135254	100.00
358.0047913	0.22
367.1908264	0.27
368.3622742	1.60
369.2697449	3.73
370.2933044	0.13
372.8929749	0.34
381.5661011	0.31
398.0817566	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	458.77
Annotation	Unknow
Peak:m/z	Relative Intensity
206.9360352	8.71
290.8477173	100.00
323.1158752	1.22
374.0405884	6.09
374.6792603	20.56
375.3486328	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	503.19
Annotation	Limonexic acid
Peak:m/z	Relative Intensity
138.1835480	0.39
161.0057068	1.72
175.1180420	0.53
217.2162476	2.95
259.1799927	0.78
265.2152405	1.70
291.2127075	23.03
309.5007935	1.06
311.3399353	4.94
323.1302795	47.00
323.8225708	4.68
341.1357117	2.83
343.1494751	0.73
353.6088867	1.23
356.1738892	0.86
372.5643921	1.17
428.4037170	1.03
453.2209778	1.77
462.3365784	3.76
467.2189026	1.99
471.1206665	1.45
485.1227722	100.00
502.6761169	1.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	787.2443
Annotation	(gamma-Glutamyl-gamma-glutamyl)-S-methylcysteine
Peak:m/z	Relative Intensity
227.2007599	0.04
230.0132904	2.13
247.3249817	1.31
247.9663696	1.26
257.2984619	0.03
265.0482178	12.52
265.6892700	0.06
283.1622620	0.08
300.6254883	0.20
301.4235840	0.03
319.1983337	1.82
331.0015259	0.04
376.4707642	0.36
377.3558960	0.04
394.2660522	100.00
395.1306152	0.16
578.4530640	0.03
657.9163208	0.05
659.2691040	0.08
689.1003418	0.07
769.1806030	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	687.1738
Annotation	Unknow
Peak:m/z	Relative Intensity
243.9332428	0.31
251.2811890	1.44
274.1962585	0.22
308.3163757	0.29
344.1066284	1.02
380.1069336	0.24
405.1910400	0.35
415.1661987	0.55
429.1930542	56.84
429.8352661	0.10
483.3569946	4.06
540.2836304	8.26
542.4028931	0.84
558.2717285	100.00
594.3223267	0.92
612.2605591	1.34
633.1325684	1.13
651.6468506	0.64
669.3806763	32.73
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	607.3963
Annotation	Unknow
Peak:m/z	Relative Intensity
255.3609924	0.98
315.5223389	0.36
316.4365234	1.38
317.2819214	0.63
335.4789429	0.33
445.3969727	0.86
461.1925049	0.39
462.1336060	1.92
463.3588867	100.00
562.8219604	1.56
563.7813110	0.20
571.2884521	0.24
590.5496216	1.22
591.3181152	0.50
610.9866333	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	555.1803
Annotation	Caledonixanthone B
Peak:m/z	Relative Intensity
167.2634277	0.27
185.2961426	0.67
210.8643951	0.41
241.0447388	3.80
259.1295776	13.14
277.2145996	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	711.2196
Annotation	Lychnose
Peak:m/z	Relative Intensity
416.6401978	0.01
432.2198486	0.03
489.3021240	0.04
503.4948730	0.04
531.2357788	0.01
549.8022461	0.06
665.3346558	100.00
666.0119019	0.21
667.2947388	0.01
675.4069214	0.05
691.6119385	0.21
692.3745728	0.02
693.3572388	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	541.13
Annotation	Cassiaoccidentalin A
Peak:m/z	Relative Intensity
160.9800873	0.30
162.2773132	0.05
178.8913879	1.12
181.2242126	0.11
198.0150757	0.05
199.2203827	0.06
203.0919647	0.02
217.1440125	0.10
233.0492554	0.48
234.1128540	0.05
251.2889252	0.02
271.1124573	0.03
275.1124878	0.04
281.0252686	0.05
305.0868835	0.17
306.2113037	0.08
323.1668701	3.08
324.3806152	0.66
325.2526245	0.28
341.1977539	0.68
342.1960449	0.09
359.2580566	0.35
360.2626343	0.64
361.2896118	2.07
377.5927124	0.03
378.2225952	0.08
379.3139038	0.39
383.3537598	0.36
384.3796997	0.02
443.0229492	0.11
444.8809204	0.20
497.6765747	0.11
503.3236694	100.00
504.2866821	64.45
505.2649536	17.73
508.0724487	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	456.1277
Annotation	Aristolactam I N-beta-glucoside
Peak:m/z	Relative Intensity
144.0651855	0.11
148.9081879	0.19
161.9688110	1.65
168.2201538	0.06
170.1835938	0.87
175.9347687	0.09
179.0382233	8.79
180.9975891	0.07
188.0911255	0.27
202.1192627	6.92
211.0637207	0.54
219.0910950	100.00
223.9485474	0.99
233.1424866	0.40
233.7689514	0.10
234.3754272	0.18
244.9234009	0.31
251.1585388	13.91
252.2189636	0.08
252.9580994	0.09
272.2763977	0.26
273.2913818	0.91
274.2139893	0.09
288.9203796	0.09
290.3718567	0.09
291.4658813	0.10
304.4049683	0.15
305.0747070	0.13
308.2135620	15.70
312.1405640	0.23
327.0626526	62.26
330.1657715	1.93
331.1491089	0.05
348.1532593	56.47
348.7631226	0.36
362.2449951	0.37
363.1400146	0.22
380.1842346	9.27
381.1258240	10.47
381.9102173	0.28
438.1567078	1.20
439.2635498	0.26
446.7304688	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	314.2683
Annotation	Palmitoylglycine
Peak:m/z	Relative Intensity
94.9626389	0.07
113.0644531	0.11
118.9450226	0.07
121.1357269	0.11
123.8666534	0.17
133.1195374	0.18
165.4059753	0.09
166.9754639	0.08
204.9566956	0.22
219.4244690	0.10
223.5172119	0.26
233.1525269	0.20
235.2041016	0.29
237.2639160	0.80
240.4272766	0.18
248.3614807	0.21
249.1637268	0.12
255.2481689	0.19
260.3904419	0.24
261.3990173	0.54
266.4736328	0.25
267.2695923	0.46
270.4385986	0.14
271.2951050	0.08
272.2075500	0.07
273.2819824	0.29
278.3822937	3.97
279.3767700	0.74
283.3114319	0.08
286.3115845	0.17
296.3122253	100.00
296.9570007	0.43
305.7619629	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	711.2193
Annotation	Unknow
Peak:m/z	Relative Intensity
392.4532471	0.08
395.8503418	0.06
417.1296387	0.17
418.1054688	0.25
447.5444946	0.07
547.4126587	0.11
613.3091431	0.27
665.4445190	100.00
666.3579712	0.08
668.4542847	0.19
676.2860107	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1029.2876
Annotation	Unknow
Peak:m/z	Relative Intensity
363.0532227	1.45
381.2285156	1.28
525.3300171	10.95
543.3493652	11.33
645.3235474	0.19
647.6898804	0.09
687.4578857	7.56
705.4095459	75.30
777.5423584	0.26
849.4736328	12.68
867.3739014	100.00
868.1055908	0.27
939.4019775	0.17
969.7102051	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	524.2
Annotation	Herbicidin E
Peak:m/z	Relative Intensity
164.0326538	0.61
165.0402679	15.46
182.0783997	100.00
199.3665314	0.86
265.0385132	2.00
289.2220459	0.61
324.8607178	1.16
344.0227051	3.60
359.5001831	0.44
361.2066040	0.86
362.1400146	2.00
394.2186279	0.86
410.0800171	0.57
506.2787476	2.72
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1015.0971
Annotation	Unknow
Peak:m/z	Relative Intensity
314.1977539	0.27
542.5095215	0.30
765.0369873	1.22
792.8529053	0.39
996.7622070	0.41
1015.1652830	0.46
1335.9870610	0.48
1428.0710450	0.23
1433.7420650	0.29
1509.1805420	0.34
1555.0242920	0.49
1568.9248050	0.25
1611.9859620	0.55
1669.9802250	0.61
1694.5338130	2.57
1710.8148190	0.87
1721.4986570	0.18
1723.2523190	0.81
1731.9093020	0.20
1733.4202880	0.15
1749.5101320	0.72
1752.5173340	0.18
1755.5350340	0.23
1763.6099850	0.28
1773.9782710	1.01
1782.7950440	0.70
1788.4163820	0.41
1801.9193120	0.20
1803.9401860	0.27
1817.3070070	2.56
1819.3341060	0.27
1821.5316160	0.25
1825.0787350	0.22
1828.5797120	28.47
1831.4562990	0.82
1832.3936770	0.58
1839.1887210	0.32
1841.6463620	0.55
1844.1444090	4.81
1845.9162600	0.20
1848.2180180	1.49
1853.4919430	0.22
1854.0969240	0.67
1862.8167720	0.50
1865.1903080	0.87
1868.2894290	3.38
1869.0720210	0.34
1870.0025630	0.81
1871.6959230	9.92
1875.5020750	0.15
1877.5035400	0.22
1878.1353760	0.13
1885.8780520	0.33
1887.2751460	0.98
1889.7620850	0.37
1890.5118410	9.08
1891.8160400	4.57
1893.6838380	3.81
1894.2872310	0.27
1895.7449950	0.20
1896.4133300	1.98
1899.2418210	1.24
1900.8728030	0.56
1902.0201420	1.08
1903.5640870	0.42
1905.7816160	4.42
1910.2457280	8.09
1912.5528560	0.35
1913.8034670	1.57
1914.4691160	0.25
1916.9719240	1.43
1918.2103270	3.11
1918.9007570	1.01
1922.4250490	0.68
1924.5856930	0.50
1926.9827880	18.15
1932.2120360	2.10
1932.9783940	0.89
1933.9334720	0.67
1935.8059080	3.49
1937.4017330	6.37
1939.0397950	0.82
1940.0085450	14.77
1941.0936280	5.91
1942.3453370	0.35
1943.4465330	0.60
1944.3913570	0.46
1946.6331790	1.62
1947.7038570	0.85
1948.9710690	2.34
1950.5233150	0.55
1951.3599850	3.26
1952.3016360	0.54
1952.9478760	0.98
1955.2927250	100.00
1956.5577390	0.92
1957.6844480	0.23
1958.4674070	2.07
1959.2489010	33.65
1961.5926510	0.36
1962.7528080	0.16
1964.5123290	2.51
1965.5277100	0.48
1966.5358890	3.31
1967.7429200	7.90
1968.7946780	4.17
1970.0797120	0.93
1971.5573730	0.60
1972.8312990	5.03
1973.8267820	3.26
1974.7691650	34.31
1975.7941890	0.72
1977.9901120	0.91
1980.6300050	8.94
1982.5124510	8.65
1983.1424560	0.62
1983.9074710	0.36
1984.5842290	0.57
1986.0506590	3.09
1987.3126220	4.96
1990.1964110	3.40
1991.3199460	0.29
1992.2281490	0.78
1993.1490480	1.08
1994.5017090	5.59
1997.2869870	7.04
1998.3414310	3.69
1999.9217530	18.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	549.1671
Annotation	Unknow
Peak:m/z	Relative Intensity
337.1362915	0.02
340.9901733	0.07
443.1162109	0.07
503.2979736	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1251.8
Annotation	Unknow
Peak:m/z	Relative Intensity
368.4055176	0.31
373.0494690	0.43
463.1827087	53.37
463.8598328	0.12
625.3060303	100.00
1088.9818120	0.13
1654.2329100	0.38
1824.5056150	0.22
1900.0061040	0.36
1901.9339600	0.18
1904.9471440	0.29
1914.8626710	0.49
1974.1641850	0.22
1982.4412840	0.12
1998.0194090	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	396.96
Annotation	Unknow
Peak:m/z	Relative Intensity
130.9807587	0.55
133.1622009	1.34
140.8907166	0.41
143.1718903	1.17
166.9868011	0.61
169.0359650	0.71
177.0508728	1.69
186.9533386	0.31
194.9551086	0.41
211.1256409	1.00
236.9722595	0.51
243.1099854	3.00
257.3250732	0.41
259.3388977	1.27
275.0152283	1.07
282.8080444	1.74
286.2536316	1.04
298.5019226	2.17
301.1456299	0.58
306.9818115	0.85
323.1296387	1.17
324.8468628	100.00
327.1528015	0.45
337.4253235	1.38
341.2312622	0.88
345.9045410	0.52
350.0983276	1.14
359.7904663	1.27
361.1383057	1.34
362.8665466	0.31
364.8950806	46.40
377.9679260	2.51
379.0070801	3.87
380.2856140	1.41
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	311.2211
Annotation	trans-EKODE-(E)-Ib
Peak:m/z	Relative Intensity
95.11232758	0.33
110.9569016	0.38
112.9699707	2.05
116.9826736	1.87
119.1521835	0.26
133.0846252	1.20
138.8109131	3.31
143.0367584	1.51
151.0737	0.36
153.1306763	2.31
156.8631287	1.29
163.2631531	0.83
166.7557678	1.58
169.2411804	0.64
175.1508331	2.51
177.2551727	0.59
181.1099243	3.30
183.1658173	2.14
185.1472778	0.56
187.8312378	0.62
189.6561432	0.70
195.1567841	1.01
197.003006	0.39
205.6221008	0.94
206.9698792	0.69
209.2005005	0.80
211.2114868	0.99
213.367981	1.32
215.1931458	1.33
222.9862366	3.12
225.2926331	3.92
233.2582397	0.75
235.8887939	0.43
237.3335571	1.62
239.3421631	1.87
240.8757019	0.48
243.1009521	0.43
246.9704285	1.26
251.1590576	1.82
253.187561	3.75
254.0067139	0.93
257.3266602	2.63
265.480896	0.80
266.2193604	0.58
267.0782776	2.12
268.425354	0.76
269.3928223	0.49
270.4154663	0.40
275.2788696	16.90
283.1848755	6.48
293.2172241	100.00
294.2187195	1.45
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	449.1065
Annotation	Luteolin 5-glucoside
Peak:m/z	Relative Intensity
113.1705704	0.06
143.8979492	0.05
145.0997162	0.16
177.1660156	0.17
182.9703064	0.12
185.3748169	0.05
255.1434631	0.08
255.9717712	0.03
283.6120911	0.03
285.1783447	0.05
287.1145630	100.00
310.8741150	0.18
314.3155518	0.14
314.9613647	0.08
329.2446899	0.83
369.4030762	0.05
390.5074158	0.05
395.0438538	0.13
398.9316101	0.06
413.3148499	0.76
413.9554749	0.09
417.3263245	0.17
421.9287109	0.07
431.4884338	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	391.2828
Annotation	Di(ethylhexyl) phthalate
Peak:m/z	Relative Intensity
149.0196075	100.00
261.7055969	18.17
279.3150024	28.61
280.1750183	26.23
288.3947144	14.24
334.0731812	11.20
361.1190796	16.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	295.1282
Annotation	L-gamma-Glutamyl-beta-phenyl-beta-L-alanine
Peak:m/z	Relative Intensity
92.8350525	0.03
103.2866974	0.02
119.9689789	15.93
131.0313263	0.23
148.2434692	0.28
149.0360718	0.47
162.0209656	0.13
166.0328827	100.00
179.1327972	0.04
186.2168427	0.25
191.0764771	0.09
196.2423401	0.26
203.1360168	0.05
217.2712708	0.12
221.2138672	0.06
232.1415405	1.58
248.8778076	0.47
253.9390259	0.44
255.1742859	0.14
259.5969849	0.71
272.8869019	0.17
274.2244568	1.51
274.8751221	0.53
277.1066284	2.28
278.1570129	10.08
281.4718018	0.63
282.8952026	0.06
283.6947632	0.25
290.6353760	0.03
294.0937195	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.1143
Annotation	D-Galactofuranose
Peak:m/z	Relative Intensity
179.1118469	0.09
206.0614777	0.02
209.0787048	0.02
341.1887817	100.00
343.8423157	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	887.467
Annotation	Nostophycin
Peak:m/z	Relative Intensity
315.3804932	0.07
357.6472473	0.04
383.4639282	0.04
403.4429321	0.10
404.3062134	0.06
411.7124023	0.02
429.5011597	0.38
430.6103516	0.07
447.4782104	7.12
448.5418091	1.34
457.0001221	0.04
472.5767822	0.02
489.6912231	0.04
490.5275879	0.05
501.4409790	0.05
507.5501099	0.04
517.4875488	0.06
543.6425171	0.12
561.5466919	0.35
562.8732300	0.02
579.4779663	6.76
580.5842285	1.33
586.5728149	0.01
589.8492432	0.16
591.6209106	0.84
592.6676636	0.19
594.5343628	0.02
604.0946045	0.02
609.5534058	17.35
610.6040649	5.17
621.5542603	0.08
622.5971680	0.04
635.8787231	0.09
643.8107300	0.09
645.4735107	0.09
649.5954590	0.09
650.6691284	0.03
651.6777954	0.11
652.6596069	0.03
657.8381958	0.02
658.8283081	0.01
663.6840820	0.03
665.5888062	0.02
666.7554321	0.06
674.0194702	0.01
674.8350220	0.05
676.6722412	0.07
677.6588135	0.04
678.6231079	0.02
687.5917969	0.07
688.7565918	0.07
704.4292603	0.02
705.5716553	1.13
706.6435547	0.27
723.5564575	6.37
724.6811523	1.37
725.5945435	7.60
726.6710205	1.58
741.5529785	100.00
742.6186523	23.60
869.5300903	0.35
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	396.12
Annotation	Unknow
Peak:m/z	Relative Intensity
117.0217896	0.02
126.1293030	0.05
126.9985809	0.06
129.2359314	0.21
144.0333252	0.31
144.8608246	0.58
146.0416565	0.69
147.1339874	0.05
161.9951477	1.68
163.0452271	1.47
164.1177673	1.53
172.0163574	0.39
173.0570068	0.31
174.0315552	0.61
179.1748352	0.07
201.0681763	0.05
202.8599243	0.06
220.2384338	0.02
230.0768738	2.13
231.0572205	4.39
232.0627441	3.67
247.8158569	9.43
249.0549316	10.62
250.1024475	9.39
258.0944214	0.03
265.1623840	58.48
266.1383057	100.00
267.2042847	78.19
276.4060669	0.06
290.1097107	0.03
291.1884766	0.28
292.1078796	0.46
292.9258118	0.26
302.0492554	0.34
303.1177979	0.28
306.2442322	0.21
319.1962891	1.31
320.2150879	4.15
321.2139893	3.32
331.0026550	0.02
332.2538147	0.44
333.2618713	0.04
339.2388000	0.04
359.1181030	0.10
360.3702393	0.09
366.9244995	0.03
376.2140808	0.05
377.2110901	1.83
378.2581482	1.97
379.1788635	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	307.0949
Annotation	gamma-Glutamyl-S-(1-propenyl)cysteine sulfoxide
Peak:m/z	Relative Intensity
87.9738617	0.17
88.8803406	0.15
90.0669327	0.10
115.8259735	0.04
117.2467728	0.05
122.0515213	0.10
129.9904480	1.38
132.0194397	0.05
160.0693665	0.13
161.3849792	0.07
162.0412292	0.16
177.9887695	1.95
178.9973145	2.48
180.0737457	6.90
188.0142822	0.03
199.0675049	0.32
200.1420288	0.22
202.3530579	0.04
217.0848083	100.00
218.0874634	39.06
219.1290283	18.91
246.1343994	0.04
247.3435059	0.04
289.9400940	0.16
291.1408997	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1084.1533
Annotation	Unknow
Peak:m/z	Relative Intensity
527.5896606	0.16
733.2171631	0.35
736.4255371	0.92
755.8987427	0.24
881.6186523	1.03
902.9919434	0.77
968.4467773	0.23
1002.7147220	2.52
1004.9012450	1.29
1007.0633540	0.68
1030.9588620	0.86
1037.6635740	1.24
1044.4926760	0.46
1045.1885990	0.67
1046.9622800	3.21
1052.1020510	3.79
1060.8183590	3.28
1063.1690670	3.68
1065.1391600	2.00
1065.8723140	3.57
1068.0271000	10.56
1068.6942140	1.06
1070.4898680	0.12
1071.8020020	6.00
1084.6210940	0.15
1092.6877440	0.79
1097.9328610	1.61
1108.4465330	1.62
1109.1539310	1.40
1114.9287110	1.39
1149.9309080	0.64
1159.7290040	0.63
1161.6203610	0.29
1165.9230960	1.37
1172.3153080	2.20
1178.0439450	2.65
1178.7958980	1.87
1181.1198730	5.08
1187.3413090	1.64
1188.9202880	2.69
1190.8166500	1.58
1196.9823000	1.30
1199.0316160	0.08
1201.8548580	2.53
1203.3027340	1.54
1205.0610350	4.09
1207.3781740	0.62
1208.0989990	6.38
1210.0642090	0.16
1212.6350100	1.54
1213.8961180	0.06
1215.3823240	2.82
1217.9531250	3.24
1219.7543950	0.33
1220.4902340	1.66
1221.6259770	5.56
1223.9926760	15.56
1224.6777340	1.70
1225.6524660	1.84
1227.0991210	10.80
1227.7800290	0.86
1230.7348630	0.62
1234.3515620	2.16
1235.4799800	0.99
1237.3468020	0.13
1239.3361820	1.31
1240.1669920	4.39
1240.9123540	3.08
1242.7099610	3.26
1243.3978270	6.26
1245.7080080	3.94
1246.7020260	1.06
1248.5437010	1.49
1252.2961430	0.28
1263.8403320	1.11
1268.7316890	0.99
1277.1511230	1.32
1312.0360110	1.23
1316.8999020	1.41
1321.9227290	0.12
1373.5968020	0.69
1400.6281740	0.81
1408.5520020	2.61
1429.6225590	0.87
1439.3282470	2.87
1461.4226070	0.35
1519.6771240	0.15
1522.7305910	0.12
1535.8132320	1.22
1587.2867430	1.02
1628.0018310	0.06
1649.6380620	0.09
1650.5621340	0.12
1684.4417720	0.07
1696.9764400	0.09
1733.3443600	0.08
1740.6546630	0.16
1765.0137940	0.07
1767.5280760	0.77
1769.2943120	0.76
1771.1451420	0.10
1771.8791500	0.34
1773.7087400	0.15
1777.6247560	0.57
1787.3729250	0.21
1790.7601320	0.16
1794.4034420	0.24
1799.1964110	0.24
1801.8331300	0.09
1802.9454350	0.13
1805.1019290	0.40
1806.3104250	0.55
1809.2927250	0.39
1814.6500240	0.17
1825.3258060	0.09
1827.2694090	0.09
1830.0925290	7.18
1834.2562260	0.66
1835.8812260	0.25
1848.9011230	0.07
1853.3912350	0.12
1855.3895260	0.41
1857.0848390	0.10
1857.8826900	4.96
1858.5579830	0.24
1862.4302980	0.07
1863.7703860	0.27
1868.9058840	0.62
1870.7604980	0.12
1873.4195560	2.37
1874.6589360	0.49
1875.8101810	0.24
1876.9249270	0.16
1879.4494630	0.50
1883.4322510	0.66
1884.6385500	0.25
1886.7984620	0.43
1889.5572510	0.48
1893.9807130	2.13
1895.2102050	0.12
1899.4499510	1.00
1900.1844480	2.86
1902.0826420	0.63
1903.1848140	0.49
1904.8762210	3.60
1906.4113770	3.89
1908.1644290	2.43
1911.6104740	0.31
1914.6296390	0.10
1916.0245360	100.00
1917.3375240	0.34
1917.9825440	0.69
1919.8381350	1.08
1925.1965330	0.20
1926.8555910	5.89
1928.4958500	0.33
1929.6232910	19.49
1934.8874510	0.08
1936.5124510	0.11
1938.0938720	0.49
1939.1656490	0.15
1942.4022220	0.12
1944.1197510	18.04
1946.0035400	0.82
1950.0017090	0.15
1950.9000240	4.91
1954.1872560	0.34
1955.6317140	1.01
1957.3616940	0.34
1959.1971440	0.35
1960.3609620	0.32
1962.8669430	2.08
1964.3835450	0.67
1965.9938960	0.70
1966.7844240	0.37
1967.9503170	0.43
1969.3479000	0.29
1970.0461430	0.39
1973.5567630	0.13
1975.7364500	2.87
1976.5567630	0.49
1977.9919430	0.70
1978.6774900	0.24
1979.5091550	2.26
1980.8084720	1.03
1982.5623780	4.03
1983.8062740	0.16
1987.8006590	0.36
1990.0733640	16.45
1990.8327640	3.27
1991.7653810	3.22
1993.3175050	3.53
1994.2146000	2.31
1996.5368650	1.95
1997.2918700	0.49
1998.3972170	4.51
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	711.2195
Annotation	Lychnose
Peak:m/z	Relative Intensity
366.2246704	0.00
367.3357544	0.00
398.1319580	0.00
415.3885498	0.01
533.1488037	0.00
549.4638062	0.01
621.4008789	0.00
665.3723145	100.00
666.4511108	0.08
667.5648804	0.01
674.9258423	0.00
691.4578247	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	470.1069
Annotation	Tuberosinone N-beta-D-glucoside
Peak:m/z	Relative Intensity
130.8193665	0.05
147.9590607	0.05
170.3009796	0.09
176.1270752	0.54
177.0744781	0.24
179.1165771	0.19
188.0807190	0.51
209.0084686	0.04
211.0173645	2.49
215.7505646	0.13
217.2147675	0.03
229.3183899	0.20
231.1914062	0.06
232.5303802	0.08
234.0679474	0.32
237.8963623	0.08
238.9608612	0.05
251.0780334	40.99
267.2270813	0.34
269.1697693	0.15
271.3600159	0.10
282.9432068	0.54
284.1029053	0.05
291.2682190	0.44
293.2357483	0.07
295.1195374	0.04
302.0581360	0.07
305.2315369	0.52
306.1538696	0.84
307.0040894	0.27
323.2633667	0.48
324.0870667	0.14
325.2226562	0.06
339.1649780	0.30
340.4761353	2.22
341.0929260	50.21
354.4573975	0.13
362.0217590	0.63
378.1829529	0.06
380.1556091	100.00
381.0920105	0.17
387.3716431	0.13
388.7906799	0.05
390.3361206	0.32
391.6198425	0.28
392.6169739	0.14
395.2110901	4.32
396.1245422	1.07
397.2035217	0.10
402.5471802	0.03
406.7792358	0.05
408.4009705	0.15
411.1305237	0.08
412.2028503	0.89
413.9742432	0.09
417.3930359	0.04
424.2974854	0.14
424.9851990	0.06
434.5606995	0.13
447.2579956	0.18
451.0850830	0.15
452.2304993	3.04
457.9934692	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	262.12
Annotation	Imazapyr
Peak:m/z	Relative Intensity
84.7400818	0.07
86.1799774	0.14
87.8819122	0.08
130.0354156	4.90
132.0607758	5.47
133.1063995	0.53
137.9175262	0.10
143.9754181	0.47
145.0246124	0.89
146.9283600	0.14
149.0247345	0.25
159.0304718	2.34
166.0541534	0.18
169.0254974	0.08
172.1354065	0.10
185.2292633	0.22
187.1108246	1.48
188.1266174	4.40
199.0049744	1.26
201.1728210	0.07
201.9964752	0.16
205.0982513	31.18
213.2400360	0.05
216.1559448	31.22
217.2762909	0.08
221.3958893	0.35
225.2922211	0.18
226.1686859	1.55
227.1529999	0.24
231.8243561	0.12
233.1774292	0.30
234.1160889	0.39
239.1290131	0.18
244.1351318	100.00
245.1789093	1.62
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	983.8115
Annotation	Unknow
Peak:m/z	Relative Intensity
606.5316162	0.36
805.5429688	0.43
1509.1037600	0.58
1580.3360600	0.58
1609.4605710	1.39
1639.8883060	1.05
1655.8724370	0.36
1659.3309330	1.02
1665.5010990	0.51
1666.6795650	0.80
1668.6846920	0.29
1674.2335210	0.32
1676.1228030	0.64
1699.6048580	0.40
1722.8494870	7.02
1740.4307860	0.58
1741.5386960	0.83
1748.3785400	0.39
1751.8177490	1.95
1754.4561770	0.36
1755.7351070	3.73
1756.7756350	0.68
1759.6999510	5.84
1763.2239990	0.80
1763.9479980	0.71
1768.3347170	10.62
1770.1680910	3.80
1772.2707520	0.40
1773.3721920	0.54
1775.6527100	0.55
1778.3825680	15.32
1779.3840330	1.11
1782.0148930	0.55
1783.4343260	0.40
1786.3392330	0.88
1786.9866940	0.95
1790.3469240	0.62
1794.5759280	0.57
1795.7160640	0.29
1798.0758060	0.66
1802.8897710	0.32
1806.1320800	1.16
1807.5769040	4.05
1811.8724370	0.40
1814.6468510	1.06
1815.4573970	0.64
1818.4500730	0.36
1819.5399170	1.01
1823.3031010	1.86
1824.4001460	5.20
1828.8021240	16.36
1833.4388430	84.68
1836.2249760	1.99
1837.7994380	1.48
1840.0773930	0.58
1841.2828370	0.83
1842.1627200	0.72
1844.3594970	1.06
1847.0792240	0.61
1851.0374760	0.54
1851.6931150	1.03
1854.1169430	2.77
1858.1563720	6.13
1858.8804930	5.83
1859.6446530	1.92
1860.8504640	0.40
1863.8629150	1.35
1866.2979740	0.60
1866.9708250	12.22
1868.6813960	0.84
1870.6195070	1.48
1871.8591310	0.29
1872.6846920	1.43
1873.2996830	0.43
1875.0012210	1.65
1876.1315920	0.61
1877.4143070	1.81
1878.3547360	4.76
1881.2718510	1.95
1881.9274900	0.46
1882.9792480	6.05
1883.9382320	0.88
1886.9437260	0.43
1888.2595210	0.57
1889.5695800	9.60
1890.3649900	2.11
1891.9333500	0.65
1893.2318120	0.87
1897.3913570	1.82
1898.8414310	0.65
1899.6356200	9.39
1900.8922120	0.54
1901.8582760	2.56
1902.6661380	59.87
1903.8380130	1.61
1906.7252200	19.40
1908.2901610	2.58
1908.9904790	1.09
1910.2686770	2.11
1911.7834470	10.19
1912.7839360	17.36
1913.3880620	14.66
1914.5731200	11.19
1915.4447020	0.97
1916.9055180	1.33
1918.7425540	4.18
1919.7243650	2.71
1920.9178470	9.51
1922.0340580	2.18
1923.5797120	1.16
1924.1995850	10.37
1925.5411380	0.79
1926.5819090	12.61
1928.3629150	10.59
1929.1190190	6.86
1930.4304200	0.44
1931.1441650	0.51
1931.7786870	1.93
1933.2272950	6.47
1934.4846190	1.19
1935.7697750	26.38
1937.1695560	5.07
1938.0363770	0.69
1939.1604000	56.27
1940.6927490	14.53
1942.6390380	5.05
1943.9268800	3.84
1944.7130130	2.74
1945.8156740	11.67
1946.6375730	5.84
1947.9055180	9.28
1949.3616940	14.10
1950.9349370	68.51
1951.8771970	79.21
1953.1239010	0.80
1954.3934330	10.75
1955.7556150	0.93
1956.4036870	4.67
1958.0964360	31.10
1959.0716550	0.94
1959.8365480	6.72
1960.8941650	7.32
1961.7424320	0.51
1962.6407470	1.94
1963.9486080	100.00
1964.8039550	18.35
1965.8454590	28.07
1966.9548340	17.94
1967.6126710	10.05
1969.6033940	4.61
1970.2458500	0.93
1971.7552490	25.10
1972.9346920	11.81
1973.6964110	6.99
1974.5369870	2.37
1975.4478760	2.14
1976.1439210	6.62
1976.9273680	2.72
1977.9055180	5.25
1979.0904540	3.37
1979.7917480	3.13
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
149.0254822	100.00
149.9879761	29.89
167.0973816	45.99
168.0367584	6.92
221.0066223	4.63
250.9845581	5.51
260.8088074	15.85
278.9273071	7.48
280.104187	37.74
285.1469727	7.59
288.0740356	2.89
306.4421997	11.55
351.7187805	2.90
372.948822	4.25
374.4339294	14.73
375.3787231	19.62
382.5596008	29.54
383.518158	4.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	556.1795
Annotation	Baumycin C1
Peak:m/z	Relative Intensity
171.9855347	0.14
173.2295380	0.14
180.1380615	0.18
191.7854309	0.51
195.8772583	0.44
208.2137451	0.60
210.1715393	0.29
226.1282654	3.02
229.9745483	1.63
238.1405945	11.67
241.9290771	0.09
247.0719604	0.16
248.0492554	2.06
256.0296936	10.15
265.1491394	24.45
274.1519470	54.86
277.5308838	0.04
339.2703857	0.32
372.9990845	0.15
375.0977783	0.41
394.4692993	0.43
421.4222412	0.05
427.4142456	0.21
445.0692139	0.81
450.8518066	0.08
463.2774658	0.08
472.2996216	21.00
481.6513062	0.19
502.2722778	11.06
502.9241943	0.05
520.1647339	11.22
520.8508301	0.11
535.8601074	0.07
538.2336426	100.00
538.8442993	0.54
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.1513
Annotation	Hexazinone
Peak:m/z	Relative Intensity
87.2924652	0.02
89.0527802	0.13
93.9540710	15.08
94.7563782	0.02
96.8907089	0.03
112.0990448	0.06
113.1148224	0.09
125.0203400	0.05
128.2895355	0.03
141.1421967	0.03
149.0127258	0.02
153.1847382	0.05
163.3053741	0.08
164.2032928	0.04
175.1915588	0.04
177.2191162	0.02
179.1358490	0.08
186.7704926	0.22
188.9334259	0.20
190.1992340	2.53
191.2836761	0.04
191.9857330	0.10
195.2395630	0.03
205.0916290	0.62
207.2592163	4.89
209.1397247	100.00
214.9716644	0.13
233.2503052	0.81
234.1622162	20.58
235.2425537	0.10
236.0490570	0.08
251.2621307	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	685.1628
Annotation	Unknow
Peak:m/z	Relative Intensity
196.9881134	0.04
202.9767151	0.07
208.2253418	0.03
210.1429443	1.43
210.8624878	0.22
214.2221375	0.08
218.2064667	0.05
225.8432007	0.04
226.4432831	0.04
228.0088348	0.03
231.4067383	0.05
236.0436401	0.05
237.3668060	0.08
249.0922699	0.05
251.8399200	0.06
254.1724091	8.22
255.0944977	0.57
256.3687134	0.10
270.1785889	0.05
272.1427002	14.56
273.2315979	1.67
286.1891479	0.72
288.1451416	5.31
289.2767334	0.37
304.1494751	4.14
306.1759338	100.00
307.2374268	9.71
319.8013916	0.05
320.9711304	0.03
325.9653320	0.08
338.1215820	19.69
339.1024780	1.74
344.1580200	0.05
346.3534546	0.05
360.1508179	0.15
363.3298950	0.07
378.2294922	2.50
379.4805298	0.85
380.1484985	0.47
381.1661377	0.18
395.3676758	0.13
404.3733521	0.18
412.1170044	10.22
413.2208252	1.09
427.1860962	0.26
428.3737793	0.07
439.3534546	0.07
538.2768555	2.11
539.5262451	0.31
542.4404297	0.04
543.6314697	0.05
556.2749634	42.01
557.3700562	6.60
561.3692627	0.09
582.7480469	0.05
639.0455322	0.04
641.5701294	0.09
649.4270630	1.07
650.5223999	0.07
667.2849731	22.85
668.3172607	4.60
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	470.107
Annotation	Tuberosinone N-beta-D-glucoside
Peak:m/z	Relative Intensity
147.9117126	0.21
167.8819122	0.41
174.6930237	0.07
175.9765167	0.58
176.8656769	0.13
188.0463562	0.41
210.9909058	2.69
217.1600037	0.84
231.2381287	0.20
233.1410828	0.61
251.0491943	64.96
251.6785889	0.35
261.1144409	0.09
262.7854004	0.14
267.0466309	1.05
275.2494812	0.38
281.2371521	0.46
283.0447693	0.51
283.9040222	0.14
288.2916870	0.34
291.3870544	1.13
305.2467041	0.66
306.0239563	0.80
323.1995239	0.61
339.1935425	0.87
341.0213013	85.27
362.0986633	1.88
372.4855652	0.13
374.2919922	0.52
380.1307068	100.00
380.8465576	0.19
395.2601624	3.55
396.0751038	1.55
398.6446838	0.29
407.0507202	0.28
410.4975891	0.88
412.0812988	0.82
426.7865601	0.48
434.5267944	0.11
452.1508484	3.37
460.5664673	0.71
469.5788269	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	385.114
Annotation	3'-O-beta-Glucopyranosyl plumbagic acid
Peak:m/z	Relative Intensity
112.9356689	0.12
121.2060547	0.06
130.9874573	0.10
149.1019287	0.58
152.9163513	0.16
161.0786591	0.15
162.0076599	0.10
164.0042114	4.46
171.0633545	0.31
175.0873718	0.05
178.9114227	0.35
179.5209656	0.02
184.0393066	0.15
190.0434113	4.15
203.0859070	0.35
205.0420227	53.86
208.1107483	1.05
209.2197266	0.18
218.0162964	0.11
219.0493164	0.03
220.3570404	0.21
221.1594391	1.33
223.0899353	100.00
231.9832153	1.35
232.9807739	0.58
235.1889648	0.15
237.2436218	1.36
247.0905151	56.23
248.9929504	0.12
251.1296082	0.33
252.8981934	0.05
254.7024536	0.05
261.4592285	0.03
263.0092773	0.13
265.1504211	8.57
268.2555237	0.14
272.0897217	0.45
277.1315308	2.22
288.2084045	0.06
289.2424927	1.72
290.1085815	0.04
293.8415527	0.04
295.1970825	3.77
305.1980591	0.14
308.9318237	0.54
311.1272278	0.21
313.0910950	0.06
316.3082275	0.15
321.1408997	0.18
322.3244019	0.04
323.3782959	0.22
324.4959717	0.13
325.2456360	5.43
336.8778381	0.10
338.5690918	0.23
339.2773132	0.59
340.2613525	0.12
340.9780579	0.22
342.1244812	0.03
349.3713074	0.06
365.1385803	0.26
367.3139954	2.49
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	337.11
Annotation	Musanolone D
Peak:m/z	Relative Intensity
99.0696869	0.04
117.0873413	0.03
118.8983841	3.34
131.9261475	0.03
144.3485107	0.16
145.1188660	0.01
156.1606445	0.07
157.0422363	0.06
162.1077576	1.18
172.7506256	0.02
179.3311768	0.06
190.2012634	4.72
191.0896301	21.76
208.0461731	100.00
217.0458984	0.03
231.1473999	0.05
232.2485962	0.06
242.4270325	0.04
245.0240784	0.02
246.9556274	0.14
255.3198853	0.13
256.0848083	0.08
257.3678894	0.04
274.1647339	1.00
276.0641479	0.19
277.2965698	0.03
279.2462769	0.03
280.0477905	0.07
281.3325806	0.06
283.4770813	0.06
290.4539795	0.21
291.3715210	0.11
295.3187256	0.08
301.1585693	0.28
307.3942871	0.09
308.7057190	0.04
309.4635620	0.04
319.1649475	1.56
320.2301331	1.84
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	243.1968
Annotation	2-Hydroxymyristic Acid
Peak:m/z	Relative Intensity
75.10997009	1.59
92.78253174	8.09
106.9910736	4.62
110.961441	2.47
120.992157	2.48
145.8598328	7.56
149.0797424	5.13
153.3431854	4.42
163.3744659	7.39
169.0101776	6.19
175.0935211	2.83
177.3031006	6.53
179.7746582	1.94
181.2927399	15.32
183.312851	1.41
184.7122955	2.64
185.5378876	9.85
197.1906281	100.00
199.1373749	47.53
207.0219116	6.55
209.1119232	4.76
215.2511139	3.86
225.1933746	75.09
225.8879852	7.68
227.2200165	16.00
228.2025757	13.83
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	325.1123
Annotation	D-Fructofuranose 1,2':2,3'-dianhydride
Peak:m/z	Relative Intensity
108.9784012	0.34
114.7920151	0.16
116.8422241	0.05
126.9783630	3.11
138.9452820	0.19
141.0351257	0.14
144.9146423	6.45
155.0004272	0.08
160.8575439	0.07
162.8907928	11.02
165.1832275	0.25
169.0998077	0.20
176.9137726	0.10
179.9535675	0.14
181.1623535	0.05
184.3038025	0.20
185.3753204	0.20
191.1980133	0.11
192.8912506	0.85
198.9502869	2.56
204.8748169	0.31
207.2697144	0.06
208.2223511	0.15
209.2313843	0.29
211.0660706	2.05
212.0927124	1.73
213.1473389	0.11
217.0346375	2.52
219.0516052	0.10
222.9537964	1.90
224.9767761	0.81
228.9656677	1.37
234.9263916	0.61
235.7143250	0.15
237.2510681	0.12
240.8016357	1.93
247.0309448	3.46
251.4889832	0.33
252.8762817	8.13
253.7742310	0.06
256.3931274	0.08
258.7631836	15.16
259.4569702	0.15
261.2127380	0.43
263.2990723	0.06
264.9745178	0.08
265.6189270	0.07
268.1787109	68.79
269.2947693	9.18
270.9807739	18.69
271.5838013	0.08
273.0136719	0.06
278.9687195	1.15
279.6802979	0.07
281.2380981	0.12
283.8974915	0.19
285.9868774	0.31
288.8505249	100.00
289.6777649	0.35
297.0917358	0.27
307.1072083	6.55
308.4313049	0.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	328.3203
Annotation	D-erythro-Sphingosine C-20
Peak:m/z	Relative Intensity
94.98231506	0.86
115.8659668	0.11
121.4895325	0.65
123.0359955	0.36
133.0440826	0.88
134.9258575	0.42
136.8303528	0.15
143.7796021	0.45
148.8670807	0.62
163.8243561	0.37
179.1560669	0.14
181.1739807	0.50
193.1286621	0.29
195.1618958	0.09
200.1861572	0.34
200.9480286	0.13
206.4793701	0.14
213.4891663	0.11
216.1829224	0.24
218.3316345	0.23
225.3894043	0.36
228.0164795	0.13
230.2508545	0.43
231.2475281	0.22
233.0244446	0.25
233.9052124	0.44
242.2128296	0.22
243.1348267	0.24
246.3922729	0.15
250.7861328	0.31
254.0925903	0.24
261.1970825	0.27
263.6603394	0.25
266.5400085	0.73
268.2081604	0.16
270.0038452	0.28
275.1983643	0.19
279.5854492	0.37
280.3063965	0.38
282.6499634	1.19
284.2148132	0.09
285.3569336	0.69
292.4313965	4.75
293.4279785	0.62
294.3373413	0.16
296.2227478	0.13
297.4344788	2.30
298.7990112	0.40
300.1705322	0.22
301.9697876	0.10
310.3203125	100.00
311.311615	6.17
318.5928955	0.71
328.1374207	0.39
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	218.1033
Annotation	Pantothenic acid
Peak:m/z	Relative Intensity
70.8651276	1.17
87.9386444	100.00
88.6800537	0.05
115.9448547	0.17
126.1938782	0.08
126.9225616	0.12
127.9585114	0.14
131.9871368	0.10
139.9945679	0.16
146.0608215	8.52
147.1228180	0.12
149.9811249	0.24
154.1273193	0.06
154.9673615	0.08
157.3841858	0.10
170.0363312	0.20
174.0856934	0.67
175.1144562	0.33
178.0550995	0.08
180.1774902	0.09
181.7345428	0.17
190.0317383	0.29
191.2305450	0.11
198.1764374	0.26
199.4472046	0.13
200.1524506	0.43
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	151.03
Annotation	Unknow
Peak:m/z	Relative Intensity
92.7462006	0.02
109.8391571	100.00
110.7975464	0.02
122.2125549	0.03
127.9132690	6.31
130.2755890	1.74
132.9277496	0.04
139.2891693	1.67
150.7433777	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	632.2044
Annotation	Unknow
Peak:m/z	Relative Intensity
179.0561371	0.11
214.7798767	0.21
221.2385864	0.25
250.8758240	0.11
281.0996094	0.03
288.9308472	0.09
323.0902710	1.49
341.1378784	0.65
383.1564941	0.05
430.6727295	0.07
439.0240479	0.08
456.8684082	0.17
469.9836426	0.19
485.1490479	0.02
498.3980713	0.02
503.3408813	100.00
522.1870117	0.16
542.1685181	0.03
554.6222534	0.16
586.1276245	0.07
614.2197876	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	625.1401
Annotation	Myricetin 3-neohesperidoside
Peak:m/z	Relative Intensity
179.0280762	0.34
198.0122681	0.36
205.0628052	0.11
221.1086426	0.05
256.0894775	0.16
259.1292114	0.07
267.4703979	0.08
279.0520020	0.13
281.3617859	0.20
285.3619995	0.07
289.2776184	0.12
298.2219849	0.08
299.0098267	1.04
301.0960693	26.37
302.1668701	5.25
303.1900024	0.12
313.1621704	0.09
314.3541870	0.19
324.7644043	0.05
333.0344849	0.53
337.3107300	0.12
341.4578247	0.06
343.1431274	1.59
344.0968018	0.57
355.4282837	0.07
367.1878662	0.13
369.1138916	0.14
380.1815186	0.08
383.4168701	0.13
385.2719727	0.06
396.3363647	0.10
399.2348633	0.13
403.1915894	0.37
433.0568237	0.07
462.1838989	9.60
463.2178955	100.00
464.2841797	33.49
476.5247803	0.34
487.5195312	0.25
488.3020630	0.12
492.1361694	0.17
505.3018188	4.24
506.2067261	0.87
534.7249146	0.11
535.8064575	0.07
536.4883423	0.08
547.6003418	0.22
563.2806396	0.07
565.2221069	0.09
566.3654175	0.26
579.3589478	0.37
580.2498169	0.14
582.6828613	0.16
590.0951538	0.14
591.3549194	0.13
607.2582397	0.58
608.4667969	1.16
617.6232910	0.59
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	581.11
Annotation	5'-Methoxybilobetin
Peak:m/z	Relative Intensity
232.9065552	1.83
254.9793854	0.06
291.1522217	0.06
306.2165222	0.05
309.0451050	0.13
324.2190552	0.04
339.2285156	0.12
350.2062378	0.08
365.9962769	0.34
367.9519653	0.12
368.9489136	0.10
369.7484741	0.06
403.2575684	0.19
404.0111084	0.04
405.1492310	0.02
406.8691406	100.00
444.8284302	17.12
445.9686279	0.23
497.0654907	0.08
533.4118042	0.03
534.1448364	0.10
534.9547119	0.51
564.1219482	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	358.2942
Annotation	N-palmitoyl threonine
Peak:m/z	Relative Intensity
109.1369553	0.03
134.6950531	0.20
141.0725250	0.06
148.9413452	0.34
154.9448242	0.03
161.3153992	0.07
163.1630707	0.08
177.2388611	0.09
189.2511597	0.10
192.9277344	0.07
203.4684753	0.14
219.0216675	0.03
229.3141174	0.11
231.4280701	0.07
251.2840576	0.15
252.3813477	0.11
259.2064209	0.14
263.4403076	0.28
268.4805298	0.13
281.6077271	0.07
287.1644287	0.75
289.5564575	0.05
295.1949463	0.21
304.4308777	2.33
305.2130432	5.10
308.9640198	0.23
310.2387695	0.15
312.2707825	0.21
316.7701721	0.21
321.8029175	0.79
322.4500732	5.14
323.3640137	0.23
326.3614502	0.55
327.3169861	0.03
329.5808105	0.15
340.3339539	100.00
341.2743225	0.23
349.3468323	0.15
364.4570923	0.09
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
151.0305786	0.59
152.0298462	0.03
179.2080994	0.05
180.4478302	0.03
193.2554016	0.08
205.1218109	0.04
223.1779480	0.03
226.1520538	0.02
227.0687866	0.07
227.8693848	0.02
241.1813049	0.03
243.3329468	0.08
244.0417023	0.03
249.1979980	0.02
269.4138794	0.03
271.1839600	0.03
272.1943359	0.03
284.2620850	0.41
285.1576843	0.51
287.2164612	0.64
299.1189270	2.39
300.1582031	4.07
301.2032471	0.20
311.2230225	0.11
313.3130493	3.09
314.1458130	28.17
315.1461487	100.00
316.1778564	0.90
321.0651245	0.02
325.1878967	0.38
326.5285034	0.01
328.1977844	0.67
329.2683716	0.11
337.1988525	0.09
341.2693176	0.10
342.2573853	0.15
355.3581543	0.06
357.2605896	4.10
358.3762207	0.06
366.0768738	0.05
369.1914368	0.02
371.6763916	0.07
381.1232605	0.01
386.0767517	0.01
387.3287354	0.23
399.2123718	0.03
401.1652527	0.03
417.1935730	0.03
423.1698914	0.01
430.1730347	0.02
445.2915955	0.04
446.2903137	0.09
449.5745850	0.01
459.1590881	0.07
462.0006714	0.03
462.6182251	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	534.11
Annotation	Unknow
Peak:m/z	Relative Intensity
160.0732117	0.10
162.0895233	0.09
170.1329803	0.11
171.1831360	0.59
172.9732819	0.07
176.0544891	0.61
176.9673157	1.08
178.9724884	0.27
185.0092621	0.26
188.0209351	1.27
194.7929993	0.55
202.1373444	1.79
208.9366760	0.21
210.9325562	1.44
215.8479614	0.05
219.1114197	13.55
221.2208710	0.72
226.8248138	1.13
233.2397003	0.43
234.0327301	0.91
245.1891174	0.16
249.0636292	0.76
251.0681305	30.41
252.1284637	0.11
255.0452423	0.13
263.0301208	0.10
266.9534302	1.66
273.1735840	0.23
274.1538696	0.14
281.0017700	0.14
291.2185669	0.32
299.0963745	0.25
305.1983643	0.27
306.2051392	0.13
307.1296997	0.93
308.1869507	0.74
309.1444092	0.25
310.3320923	0.19
315.1655884	1.04
324.8233643	0.67
327.2611084	0.11
329.3806152	0.08
330.2489624	0.29
331.4451294	0.07
338.1115723	0.67
339.3160400	0.08
348.1593628	6.12
352.9448853	0.08
355.0621948	0.89
356.0320435	0.12
361.6384888	0.14
362.3129883	0.35
363.2872314	0.14
364.4393311	0.09
371.0705566	0.12
373.0397949	1.32
374.1041870	0.10
377.1075439	0.20
379.5195312	1.65
380.1357422	27.90
386.9634399	0.65
396.3678589	0.14
397.2600098	0.22
405.0808105	100.00
412.5676880	0.94
413.6627808	0.30
425.2877197	0.36
437.2449951	0.07
445.1342773	23.59
447.6683350	0.44
454.3950806	0.62
455.2857056	0.55
459.1000366	16.59
462.2864990	0.09
469.8226929	0.36
470.8995972	0.17
471.5631714	0.20
480.8262329	0.29
484.4111938	0.09
488.2162476	0.98
489.6057739	0.09
493.0866089	0.35
502.0595093	1.12
505.2898560	0.09
506.3414917	0.83
506.9514160	0.20
510.6664429	0.29
513.1956177	0.30
516.1601562	3.68
517.0994263	0.34
517.7056274	0.12
524.8444824	1.86
525.9038086	0.32
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
109.1206131	0.16
113.9587173	0.10
129.9788666	0.69
134.0830688	1.36
139.9829407	0.09
148.9755859	0.24
159.7509308	0.93
162.9040070	0.19
174.0140686	5.38
177.9645081	6.87
181.1391296	0.28
186.0842133	1.32
199.1678162	0.26
215.2527161	2.19
217.0393677	100.00
219.1565552	0.57
233.0780640	0.11
235.1336670	0.09
237.1141357	0.15
243.2824707	7.23
246.9559326	0.18
248.9593506	0.28
259.4307861	0.20
261.1267090	2.04
261.8372192	0.24
265.5883789	0.47
270.7998962	0.20
271.4699707	0.43
275.5372925	0.29
279.3858032	0.20
288.8582764	1.67
289.6164856	0.48
290.9891968	0.56
294.5182495	0.16
297.1291504	0.17
297.7420044	0.54
307.2592163	0.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	391.2827
Annotation	Di(ethylhexyl) phthalate
Peak:m/z	Relative Intensity
145.6491699	24.06
149.0214996	100.00
150.1310425	31.87
166.8656311	82.57
167.967926	50.50
225.9964905	18.27
260.4497681	42.71
262.2021484	23.16
278.9720459	32.37
280.164856	9.76
END