#DEFINITION	Reference Metabolome for Daucus carota
#IDENTTFIER	RefMeta-Daucus carota.R1
#FORMAT	msr
#VERSION	1.0/R1
#KEYWORDS	RefMeta
#ORGANISM	Daucus carota
#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 Daucus carota 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	positive
CollisionEnergy	NA
PrecursorMz	391.2833
Annotation	Di(ethylhexyl) phthalate
Peak:m/z	Relative Intensity
121.119339	13.85
135.0138245	6.97
136.797348	8.35
140.9874878	10.32
144.6335602	1.21
149.0192871	100.00
150.0460815	26.56
167.176178	18.43
168.0729065	10.80
180.7145386	3.31
189.0960236	6.64
195	4.55
197.2855072	5.35
212.9173279	3.28
239.0047302	5.79
242.3961792	4.89
243.4394836	3.67
257.1665344	4.00
258.265625	4.53
260.7066345	10.02
265.1448364	1.57
270.4455566	3.31
278.9193115	1.92
280.091217	21.63
287.3877869	7.34
295.3267212	10.27
301.3736877	4.32
302.1106567	3.49
304.1651611	2.40
325.3033447	1.73
331.5574341	2.62
332.1943054	8.02
338.557251	2.79
343.3283081	12.24
346.2826538	12.77
348.5791931	4.83
351.306366	5.01
356.7909546	12.60
361.1992188	6.74
374.3158875	7.55
375.2326355	4.94
382.7732849	24.38
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
95.0697937	0.64
100.8344116	1.33
109.1614761	0.55
110.9396744	0.20
113.0471954	0.19
119.2636414	0.16
121.1613617	0.82
123.0158081	1.58
128.9786987	0.46
133.0495911	0.52
135.155838	0.11
136.7765503	1.22
139.061554	0.28
140.6485901	1.11
142.8396912	0.90
145.3106079	0.16
147.0211792	0.38
149.2375488	1.33
152.9402313	0.73
155.0810394	1.92
156.9446106	0.73
160.8553162	0.50
163.0857239	1.51
164.6741028	0.15
166.9610443	0.11
168.5492859	1.24
169.2144012	0.25
171.0492859	0.88
173.0102081	0.12
175.144043	0.44
177.1305237	0.74
179.1080933	0.66
181.1422119	1.21
183.3131104	2.12
189.2456818	0.27
193.2042542	1.59
195.1639252	0.42
197.0899811	2.45
201.532135	0.53
202.3174133	0.48
207.2075806	2.96
209.3151855	0.41
211.1322327	1.45
212.3209229	0.34
213.1751709	0.72
215.0419922	0.73
217.1160278	0.40
219.6376343	0.90
220.2739868	0.46
221.3607483	0.33
223.1113281	0.76
223.9559631	0.36
225.0306396	2.01
226.5653076	0.85
227.2598267	3.42
228.4776917	0.24
229.3103027	0.59
230.7356567	0.09
231.3863831	0.16
233.306366	0.38
235.4081116	1.23
237.084137	1.33
239.1014404	0.79
240.8876343	0.90
241.8722229	0.85
243.0905151	0.23
245.2421265	0.24
247.2437439	1.08
249.2535095	0.39
251.2295227	1.81
253.1677856	8.25
255.1649475	2.02
257.1535645	0.50
265.2849731	3.12
266.4743652	0.46
267.1174316	1.57
268.3995972	0.86
269.4778748	1.17
270.2541504	1.45
270.9169617	0.68
275.2115173	17.25
281.3104553	0.79
283.1507874	5.40
287.5979919	0.83
293.2130127	100.00
293.8416138	0.24
302.4924927	1.78
310.3947754	0.20
311.5779114	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	345.1472
Annotation	Unknow
Peak:m/z	Relative Intensity
129.8738403	0.36
136.9985657	0.62
166.8718872	0.40
168.1803589	0.57
177.0921936	0.62
183.0238342	0.26
185.3094635	0.80
194.1373901	0.41
213.0949097	0.75
215.3433533	0.56
218.5195312	1.23
232.1793823	0.40
245.3366089	2.91
247.0654297	0.70
248.4071350	0.48
261.1287842	0.53
263.1917725	0.42
267.0115662	0.33
271.0286865	0.35
272.0054626	0.31
273.1582642	0.77
274.0976562	0.33
275.6286011	3.08
281.3298950	3.74
282.2529297	0.20
283.6873474	1.28
292.3875732	0.69
299.1810608	2.73
303.2642212	0.42
304.1025696	0.30
308.4119263	0.47
309.1157837	2.84
313.1228333	0.60
314.6055298	1.46
315.3999023	0.41
327.1852112	5.82
328.1799622	0.74
336.2236023	100.00
337.3259277	1.16
340.0821228	0.81
380.0471497	0.72
421.0677185	0.27
437.3053284	4.87
455.2400208	5.05
491.4564819	0.71
509.2504272	1.03
524.4030151	0.82
542.2889404	0.58
549.9834595	0.68
560.1517944	0.13
566.4216919	4.45
568.3541870	0.89
582.7683105	0.44
584.2846680	10.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	476.2782
Annotation	PE(18:2(9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
140.1512909	0.01
152.8433990	0.05
183.9998169	0.01
188.3061218	0.04
196.0378723	0.23
214.0830688	1.03
259.5107117	0.02
261.5848083	0.08
279.3191528	100.00
301.3605957	0.03
324.8369141	0.04
327.4304810	0.01
390.2805481	0.03
392.3756409	0.02
403.2538147	0.05
407.3732605	0.05
415.7447205	0.04
422.3480225	0.03
427.2565918	0.02
457.6422119	0.07
458.2579346	0.02
459.0703430	0.02
462.4740295	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	311.17
Annotation	5S-HETE-d8
Peak:m/z	Relative Intensity
93.0537796	0.18
96.91381836	0.76
98.87432861	1.19
113.2823563	0.51
141.0119324	0.22
143.0641785	0.23
156.0683289	0.23
169.9532471	4.02
178.8216705	0.39
183.0140533	100.00
183.9405823	9.41
184.5984192	0.17
185.3179626	0.57
197.1277771	9.71
198.1292419	7.87
199.1321564	0.97
209.2196045	0.23
210.9242249	0.91
212.0032654	3.26
223.0705566	1.03
225.0101318	2.36
226.2792358	2.41
239.2133789	7.11
240.1698608	4.53
241.2385559	0.94
243.3157349	0.70
247.3043213	5.10
249.304657	2.17
254.1553955	0.96
255.2511902	1.32
264.1100159	0.18
265.1737366	0.35
267.2385254	7.94
268.3231506	0.21
269.4338989	1.54
275.2645874	1.07
281.3179932	0.35
292.3162231	0.17
293.327179	13.34
294.2646179	0.27
295.3286743	0.21
311.2887268	12.30
312.5658264	1.92
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	351.1295
Annotation	Unknow
Peak:m/z	Relative Intensity
100.9864273	3.86
101.7949524	0.04
102.9010620	0.21
112.9384613	9.25
117.0350113	0.09
119.1568604	0.11
129.0019226	0.16
130.7648773	0.07
141.2721710	0.17
149.0194702	0.05
154.8500061	0.08
156.9340820	0.98
163.1211700	0.23
169.0743408	0.08
173.2055969	0.23
175.0207520	2.53
182.9893494	0.26
187.2059326	0.47
188.1184235	0.11
189.1556396	0.06
202.8795471	0.08
205.1345825	3.09
215.0857239	0.07
219.2763062	0.11
221.0780945	0.06
223.2866821	0.89
231.0990906	8.60
234.3390503	0.04
243.1167908	0.66
249.1665955	100.00
250.1730347	0.12
257.2104797	0.11
259.3673096	0.18
260.3582764	0.08
262.5709839	0.08
267.1052246	21.04
271.3278809	0.08
280.1471558	0.21
289.2979126	0.22
291.1844177	2.56
297.2680054	0.19
304.2670593	0.16
305.1437378	0.60
307.0319824	0.20
315.1031494	1.21
323.1150513	0.08
333.2849121	21.24
336.4876099	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	361.1505
Annotation	[3R-(3alpha,3aalpha,4beta,5alpha,6aalpha)]-3-[(beta-D-Gulucopyranosyloxy)methyl]hexsahydro-4-(hydroxymethyl)-5-methyl-2H-cyclopenta[b]furan-2-one
Peak:m/z	Relative Intensity
135.2098541	0.06
137.1302490	0.41
138.0691833	0.04
146.1925201	0.02
153.2386627	0.08
155.0885620	25.94
156.4153748	0.07
178.9317322	0.20
181.1372681	0.60
190.2153320	0.02
199.0840912	100.00
206.1270752	0.09
225.2514343	0.03
235.2344055	0.05
242.1693420	0.06
253.5169373	0.04
271.1594849	0.03
280.2388611	0.05
281.4089966	0.08
287.0661621	0.06
289.3333130	0.02
301.5129700	0.11
315.1688538	0.33
317.1554565	0.18
325.2496033	0.05
327.3145142	0.03
343.3147583	1.83
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	544.3785
Annotation	Unknow
Peak:m/z	Relative Intensity
153.1687012	0.21
154.2627869	0.46
155.2647400	0.31
156.2445068	0.27
157.0565186	0.54
158.0572510	0.34
160.2867889	0.12
164.9337311	0.74
166.0167084	0.49
167.1530304	0.14
167.8655243	0.25
169.0881958	0.57
170.0053711	0.17
171.1690674	0.33
173.0375214	0.19
177.1389465	0.15
178.1129456	0.70
179.0275421	1.24
180.1132812	0.30
181.3158875	0.21
182.2909241	0.23
183.2422180	0.38
185.3480682	0.09
188.1264954	0.45
190.1385193	0.32
191.2829895	0.71
192.2374268	2.27
193.1542053	1.30
194.1885376	1.19
195.3199463	0.42
196.0891571	0.39
197.2575989	0.33
199.2474213	0.65
200.2499237	0.57
201.1322632	0.55
202.1991425	1.65
203.2643433	0.58
204.1703491	0.07
205.1401062	0.41
206.3477173	0.20
207.0782471	0.92
207.9802856	0.13
208.8980103	0.10
211.2708740	0.09
212.2746735	0.51
213.9564819	0.26
215.0312195	0.73
216.3099060	1.62
217.1905212	1.02
218.0906982	1.88
219.2201538	1.58
220.2884216	0.94
221.2488556	0.58
222.1604156	0.63
223.2289886	0.38
224.3054352	0.84
225.1944733	0.49
226.1476440	0.09
226.9094238	0.21
227.8207397	0.12
228.6639557	0.21
229.4006042	1.85
230.4393616	2.11
231.2460938	2.40
232.3198242	1.84
233.1617737	0.99
234.2360535	1.00
235.3832245	0.82
236.2042847	0.12
237.1325836	0.74
238.0451355	0.47
239.1148987	0.42
240.0503082	0.52
241.1992188	1.55
242.2299652	1.22
243.1647034	0.78
244.3155823	2.02
245.3097992	1.05
246.1589966	1.89
247.0023041	0.63
247.9886475	1.53
250.2593536	1.97
251.2380676	0.59
252.2248535	0.32
253.2763367	1.50
254.2502136	0.20
255.2299500	0.97
256.3499756	0.56
257.2207336	2.73
258.2835083	1.00
259.1805725	1.47
260.2415771	1.40
261.4178772	1.19
262.1722412	1.50
263.0540771	1.06
264.2347717	0.78
265.2335205	1.00
266.4183044	0.85
267.2548523	0.49
268.3735962	0.90
269.2091064	0.89
270.2116699	2.40
271.2136230	0.13
272.3089600	1.37
273.0670166	0.84
274.3229980	0.72
275.2491455	0.89
276.2406006	0.95
277.1813354	1.24
278.3136292	0.11
279.3359375	0.59
280.1400757	0.51
281.2962341	0.31
282.1861572	1.30
283.2412109	0.86
284.1778564	0.70
285.3630981	1.94
286.3123779	2.80
287.3237305	1.67
288.4138184	2.26
289.4571533	1.98
290.2020264	1.20
291.3140869	0.51
292.4150391	1.31
293.1080933	0.40
294.3483276	0.54
295.4641113	1.01
296.1859131	1.80
297.5429077	0.60
298.2628174	1.84
299.3245850	1.54
300.2652588	1.41
301.2832031	1.46
302.2350464	0.36
303.1648560	1.44
305.2439575	2.36
306.1074219	0.27
307.3535461	1.69
308.4229431	0.68
310.3863525	0.24
312.3377075	1.06
313.5222168	0.12
314.3231812	0.80
315.2624512	2.42
316.3206177	0.89
317.5881348	2.00
318.4524536	2.56
319.3610840	1.82
320.1708374	1.58
321.1839600	0.73
322.3548584	0.63
323.4229126	1.60
324.3299561	1.31
326.1610107	1.34
327.4345703	1.31
328.4370728	1.06
329.3467407	1.49
330.3077393	1.78
331.4113770	1.85
332.4157715	0.94
333.2976685	2.52
334.3656616	2.05
335.4224243	0.66
336.5104980	1.21
337.4489746	1.50
338.2250977	0.88
339.1970825	0.64
340.3117065	0.50
341.3764648	0.74
342.3525391	1.22
343.3624268	1.04
344.3058472	3.40
345.1870117	2.04
346.3788452	2.71
347.4558716	1.73
348.3537598	0.99
349.5139771	0.58
350.3114624	0.38
351.2644653	2.52
352.2435303	1.41
354.5784912	1.23
355.4270630	0.60
356.3450928	1.61
357.3531494	1.82
358.3798218	1.32
359.7622070	1.94
360.5861816	3.30
361.3967896	2.70
362.4683838	4.53
363.3410645	1.83
364.5343628	2.67
365.3175659	1.18
366.1762085	1.02
367.4289551	1.22
368.5294800	0.26
369.3150024	1.11
370.4066162	3.13
371.3742065	1.80
372.3716431	2.41
373.4144897	1.56
374.4202271	2.98
375.4973755	2.45
376.4418335	1.13
377.3583374	1.00
378.3744507	1.22
379.5991821	0.10
380.6058960	1.59
381.3172607	0.72
382.4731445	2.37
383.4024048	1.27
384.3970947	3.30
385.2844849	1.84
386.3887329	2.49
387.3281250	0.84
388.3756104	4.18
389.6110840	1.40
390.4044800	3.96
391.5401001	1.20
392.5001221	2.05
393.1649780	0.74
394.4952393	0.07
396.5940552	1.06
397.6098633	0.27
398.5179443	7.23
399.4887695	6.03
400.5469360	6.62
401.4417114	3.48
402.4007568	4.83
403.4281006	2.64
404.5555420	2.58
405.2717896	0.42
406.2174683	0.64
408.4890747	1.33
409.3817139	0.13
410.3932495	1.44
411.5386353	1.10
412.4379272	1.81
413.5886230	1.70
414.7554321	3.95
416.3701172	30.67
417.5143433	16.14
418.5493164	5.28
419.4984741	2.78
420.4040527	1.75
421.5602417	0.54
422.6109619	0.12
424.4178467	0.12
426.1518555	1.86
427.4099731	2.90
428.3583984	2.77
429.3604736	2.26
430.5298462	3.58
431.5079346	4.37
432.4404907	3.35
433.9877930	0.62
434.6066284	9.20
435.5910645	6.08
436.5209961	0.11
438.8469238	0.79
440.6247559	0.60
441.7360840	0.73
442.3783569	1.97
443.3836060	1.20
444.5396729	2.50
445.4489746	5.03
446.5104370	6.05
447.3500977	3.88
449.2072144	2.53
450.5494385	0.26
451.7313843	0.81
452.6911621	0.32
454.4805298	1.06
455.5449829	1.10
456.4611206	1.52
457.3941040	1.50
458.6608887	3.39
459.4594116	3.41
460.4671631	4.02
461.5637207	3.53
462.4133911	3.98
463.9884644	1.39
464.7758179	0.12
466.9294434	0.74
467.5621338	5.68
468.5419922	1.17
469.7943115	1.34
470.4451904	3.84
471.3984375	4.84
473.5418091	0.83
474.5778198	1.29
475.5636597	0.64
476.5502319	0.16
477.3038940	0.47
478.4308472	0.61
480.6561890	0.80
481.5075684	0.70
482.3969116	1.23
483.6735229	0.44
484.6858521	3.93
485.5786133	6.80
486.6436768	3.16
488.3283691	7.45
489.5449219	2.51
490.5756226	1.90
491.5875854	1.42
492.5402222	0.87
495.1869507	0.18
496.5244141	0.73
497.6436157	1.16
498.5932007	21.33
499.5688477	8.78
500.5901489	3.49
501.5446167	1.19
502.5260010	3.97
503.4445190	5.76
504.1245728	1.16
505.0996704	0.56
506.3734131	0.29
507.3209839	0.56
508.5142212	4.80
509.4851074	2.39
510.3735962	0.58
511.3435669	0.48
512.2076416	0.31
513.2423096	0.93
514.5614624	4.66
515.5763550	3.91
516.5654907	16.87
517.6095581	5.74
519.0490723	0.56
521.2458496	0.54
523.3572388	0.53
526.5299072	100.00
527.5192871	38.79
528.3093872	2.11
529.5722046	3.14
530.5485840	0.58
531.3546143	0.49
532.7445679	0.21
535.5254517	0.86
539.3715820	0.22
542.5355835	0.44
543.5657349	0.10
544.6171265	4.25
545.5129395	0.91
546.4245605	4.46
547.3524780	3.02
548.2001343	0.80
552.3037720	0.38
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	507.2443
Annotation	ID14326
Peak:m/z	Relative Intensity
145.1358337	0.14
161.0417480	0.04
163.0462036	3.63
164.1928406	0.33
169.5093079	0.02
205.0690002	0.25
233.0423279	0.17
234.7511597	2.31
236.1730042	0.22
241.4165955	0.09
253.1007996	0.11
264.7915039	2.31
265.9837952	0.46
277.2308044	0.15
285.3677979	0.22
289.8735046	0.03
292.9211426	0.06
295.2150879	0.15
300.9257812	0.03
307.2179871	0.38
308.1468506	0.20
325.0743408	2.04
326.0924683	0.34
327.2589111	0.05
328.3106079	0.07
333.3923340	0.06
343.2935181	0.04
345.4148865	0.08
359.1633301	0.11
360.0510254	0.18
370.4636536	0.14
390.1859131	0.07
407.6894226	0.08
412.4579468	0.11
417.2719421	0.16
424.6076355	0.17
426.5546265	0.06
436.3014221	0.12
454.3271179	0.07
461.2477722	100.00
462.3471375	31.75
464.3225098	0.39
471.6360168	0.13
472.5330505	0.05
490.2315369	0.35
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	315.1541
Annotation	Unknow
Peak:m/z	Relative Intensity
90.9423065	0.36
111.8964691	3.34
139.8996277	2.67
158.0387573	100.00
174.1199188	0.84
176.9625549	0.48
185.0743713	0.74
192.7826843	0.38
223.0506592	0.43
235.1817322	0.80
237.1553345	1.87
260.0256042	0.38
268.0546875	0.51
273.6339722	0.41
274.2735901	0.75
279.4710388	0.49
297.2343140	0.44
301.7507324	0.68
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	630.8782
Annotation	Unknow
Peak:m/z	Relative Intensity
201.2194977	0.03
215.0526733	0.07
216.9662323	0.03
229.0883636	0.07
245.1401367	0.14
246.7706909	0.10
273.0658569	1.56
274.3804932	0.02
289.0583496	3.09
305.3070984	0.07
370.1010132	0.07
386.9847412	2.02
403.0479736	16.94
446.0936890	0.02
496.9332886	0.03
500.1124878	0.09
500.9939575	0.41
515.0162964	0.32
517.0018921	100.00
525.0701294	0.02
538.7970581	0.03
555.9387207	0.06
557.1614380	0.05
581.9750977	0.11
584.0656128	0.59
584.8832397	0.75
585.8712769	0.04
587.1234741	0.05
587.9242554	0.20
599.4262695	0.16
612.1044312	0.03
613.0631104	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	285.0616
Annotation	Uralenneoside
Peak:m/z	Relative Intensity
92.9985275	0.29
107.8409424	2.13
108.9933014	6.85
114.0437164	0.27
119.1453552	0.04
120.9860306	1.34
123.0339737	0.68
130.0476074	0.14
133.0795898	0.35
136.7928162	0.13
138.7715454	0.16
143.1119690	0.08
147.1877441	0.12
150.9461365	3.81
151.9756470	22.37
152.9421692	100.00
154.1734772	0.04
161.9617462	0.25
163.0142212	3.58
165.0160217	4.53
167.2042694	0.29
169.0054321	0.14
175.3206787	0.04
177.1268463	0.26
179.0741425	1.83
181.0621643	1.23
181.9779968	0.15
182.9756012	0.07
193.1390686	1.10
195.1162415	0.78
197.1300354	0.12
200.1727905	0.12
203.0702820	0.48
204.9884949	0.47
207.0755005	1.22
211.0961914	0.05
212.5969543	0.06
213.2832031	0.25
219.0313721	0.25
221.9966431	0.03
223.2238464	0.04
225.0197144	2.29
231.0894165	0.14
237.0267334	0.17
240.9028320	0.84
241.8906250	0.12
249.1138916	0.09
258.2020264	0.11
263.2782288	0.07
266.1311646	0.04
267.2086182	1.72
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	431.1194
Annotation	Griselinoside
Peak:m/z	Relative Intensity
125.0275116	43.29
142.3527222	4.52
143.0119324	12.57
151.1584778	0.20
161.0051422	6.78
165.1398621	1.92
167.0728912	3.39
173.0585632	0.59
176.8473206	0.23
179.0269470	8.03
182.8805695	0.61
184.9212036	0.18
191.0288391	3.25
202.9546509	41.09
207.1976624	0.30
214.9559326	0.72
224.9687195	5.43
233.3327026	1.35
239.8879089	0.25
242.4813232	2.91
243.1544189	14.69
250.8842163	0.84
261.3283386	0.18
269.0844727	1.51
285.6983643	0.16
286.9876099	13.52
299.0468140	1.06
305.1222534	9.63
311.3414307	0.86
329.0787964	100.00
343.2732239	0.23
368.4538269	3.35
369.1893616	39.46
385.0307312	0.63
386.9845886	4.17
413.7304993	0.75
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	386.1071
Annotation	Zeanoside C
Peak:m/z	Relative Intensity
119.0885391	1.03
135.9557343	5.08
139.7709961	0.07
144.9919434	0.22
146.9247284	1.38
163.0813904	0.18
165.0115967	11.73
182.0166931	100.00
182.9907227	0.14
203.5512085	0.12
204.2253265	0.18
213.0262146	0.21
217.1282654	0.12
223.1644592	0.24
226.0537720	0.09
232.1344604	0.21
237.0683899	0.14
242.9495850	0.36
250.0812378	0.59
252.0525818	0.08
252.8388367	0.16
268.7943115	0.15
276.9878540	0.42
277.9529419	0.29
278.9487305	0.06
296.1881409	0.37
323.2879028	0.27
325.0311279	0.20
326.0258789	1.05
327.2287903	0.11
329.3259277	0.50
340.2462769	0.11
357.8226013	0.19
363.1816711	0.15
365.3103943	0.45
365.9234314	0.06
367.2727051	0.25
368.6954041	0.61
369.3578491	0.12
377.2170105	0.34
378.9380188	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	493.23
Annotation	L-Linalool 3-[xylosyl-(1->6)-glucoside]
Peak:m/z	Relative Intensity
312.4364319	0.02
313.0671997	0.07
341.5081177	0.02
343.2181702	0.03
371.3187866	0.04
430.6700134	0.03
447.3087769	100.00
448.0091248	0.19
449.2451782	0.07
454.8488464	0.03
457.3496399	0.02
467.5296936	0.03
472.4744263	0.02
474.4155579	0.04
485.0596619	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	630.7833
Annotation	Unknow
Peak:m/z	Relative Intensity
191.0696106	0.41
206.8653259	0.83
258.9305420	1.96
274.9387512	2.28
290.4461670	0.21
326.7979736	1.76
342.7355957	3.57
343.3935547	1.51
358.9153442	1.12
394.7735596	4.92
410.7440796	15.86
426.7009888	2.82
431.9550171	0.35
435.2058716	0.19
449.2500000	0.34
462.8374023	4.87
478.7114868	100.00
479.4223633	0.13
494.7105103	96.12
495.4319458	0.36
544.8814697	0.19
546.7318726	48.73
547.3498535	0.47
562.0412598	0.72
562.6998901	19.33
584.2128906	0.22
587.8651733	0.42
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	400.1803
Annotation	Unknow
Peak:m/z	Relative Intensity
118.0278778	100.00
191.1529541	0.17
218.7545013	2.46
238.3537903	0.14
250.3265381	0.33
262.6330261	0.81
265.0360718	7.51
283.0003357	1.07
315.0897217	0.37
327.5650024	1.13
336.7678223	0.14
338.5180969	0.35
341.1555786	1.34
382.1836853	0.73
391.2708435	0.70
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	299.0771
Annotation	Pseudolaroside A
Peak:m/z	Relative Intensity
92.92906952	3.08
118.5516663	0.26
137.0258026	100.00
140.2326965	0.19
170.8392181	0.15
179.0758667	0.66
183.1223297	0.12
199.9481812	0.23
203.0358276	1.89
209.0776978	0.35
225.0640869	0.49
227.2120972	0.39
238.9004822	0.51
241.3225098	0.09
253.1222229	14.38
255.0594482	0.70
256.3432312	0.16
262.8659363	0.37
263.5014343	0.25
268.9178162	0.79
271.1523132	0.43
279.2853088	0.12
279.9802551	0.51
281.3647461	2.38
282.0585938	0.31
284.1207886	0.24
290.1546021	0.52
299.1726074	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	374.81
Annotation	Unknow
Peak:m/z	Relative Intensity
206.7643738	0.45
212.8419495	0.33
219.9716187	0.21
266.8406982	0.55
284.9092407	0.31
290.8307800	100.00
307.0614624	0.82
314.9911194	0.75
357.0911865	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	514.2126
Annotation	Zeatin riboside-O-glucoside
Peak:m/z	Relative Intensity
185.5417328	0.45
202.2255249	0.10
220.1865540	6.39
245.0076904	0.54
268.1464233	0.51
340.3853760	0.11
345.5272217	0.27
346.9091187	0.14
351.6484375	0.26
352.2637329	4.37
382.3082275	100.00
436.2815552	0.32
441.1889648	0.31
455.0739746	0.28
496.5140381	0.36
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	191.0562
Annotation	Sedoheptulose
Peak:m/z	Relative Intensity
58.9754486	5.12
60.9590454	1.69
66.7701950	0.60
68.9911804	0.12
70.9023590	6.58
72.9089584	0.67
80.9874878	0.35
82.9048462	1.88
84.9619598	90.00
86.9570999	16.21
92.9934540	55.15
93.6251373	0.39
96.1164856	0.54
96.8939514	0.47
98.9630585	3.22
101.1073761	0.41
107.7187042	0.23
108.9055176	23.76
110.9933319	35.53
112.9570007	0.46
114.9852295	1.46
123.0025635	0.29
126.9531555	100.00
128.9971924	2.36
136.8825684	2.70
142.9727325	2.64
144.8758087	1.65
147.1143494	0.65
152.9862213	6.45
155.0221558	7.46
171.0633698	25.30
172.9882355	87.44
191.0929718	0.62
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	346.1277
Annotation	3'-O-Acetylisopteleflorine
Peak:m/z	Relative Intensity
143.9762573	0.15
154.9234924	0.36
187.0412903	0.09
214.0880127	0.12
219.3233032	0.48
237.2467651	1.76
244.3892822	0.08
256.0895996	0.20
260.7920532	0.10
265.1953125	8.60
283.1180420	38.82
287.2652893	0.17
293.2783813	0.31
300.2401733	100.00
301.9210815	0.12
305.0638733	0.16
311.1590576	4.02
326.2691345	0.28
329.0204773	62.44
329.6908264	0.18
337.9502869	0.50
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	299.0772
Annotation	Pseudolaroside A
Peak:m/z	Relative Intensity
92.96250153	4.16
119.0954208	0.32
137.022522	100.00
139.1059265	0.14
151.1779633	0.20
169.0342407	0.15
179.1294556	0.86
199.1093445	1.09
202.9242249	0.62
207.1677246	0.28
227.2363281	0.60
237.1980286	0.23
239.2635803	0.32
253.050293	5.36
253.9647522	0.14
255.2212524	0.69
262.9360352	0.12
269.3757935	0.28
270.3205261	0.57
278.339386	0.61
280.0993652	0.41
281.2155762	0.52
283.9285583	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	291.1293
Annotation	N2-(3-Carboxy-2-hydroxy-1-oxopropyl)arginine
Peak:m/z	Relative Intensity
97.9053497	0.03
111.9861908	0.33
112.7872009	0.05
115.7608261	2.20
116.4282608	0.04
125.0855942	0.04
128.5814056	0.15
130.1018829	1.02
134.1374207	0.11
140.8164978	0.17
142.8826294	0.03
146.8624268	0.07
148.1789856	0.25
157.1730194	3.47
158.0852661	1.48
161.2191467	0.02
175.1281433	100.00
176.2824860	0.15
192.4490662	0.60
193.0721741	3.05
195.0216370	0.15
197.0483246	0.04
200.5428467	0.11
210.7987061	0.04
213.2000732	0.94
214.1276550	0.59
220.0609436	0.05
221.0384521	0.16
226.0045776	0.17
231.1302795	2.71
232.1340637	0.64
238.0181885	1.04
239.4013977	0.09
245.0852661	0.50
249.1856079	0.19
254.5373840	0.07
256.1329041	3.19
256.9898682	0.10
270.0805969	0.07
272.1516113	0.19
273.2368774	1.94
274.1112061	1.43
274.7528992	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	745.5177
Annotation	Unknow
Peak:m/z	Relative Intensity
214.1329193	0.10
216.0924072	0.10
216.9862671	0.52
221.1188660	0.15
223.2751617	0.37
225.1730194	0.36
226.0869141	0.10
227.0010376	0.61
229.3798065	0.14
232.2256622	0.20
233.0848694	0.46
236.3561401	0.30
239.1702881	0.30
240.2282867	0.56
241.0665283	0.58
242.1850891	0.16
243.2199097	0.89
244.3500671	0.42
245.4172821	0.88
246.1295013	0.11
247.3143005	0.73
251.9855347	0.31
253.1121826	1.28
255.1979065	0.35
257.2369385	0.59
258.0509644	0.89
259.3894043	1.15
261.0446167	0.73
262.3723145	0.67
263.2580872	1.04
264.1473389	0.42
264.9679565	0.34
265.9969482	0.33
267.2976074	0.87
267.9172363	0.20
269.3647156	0.80
270.1759949	0.12
271.0929260	0.12
273.3064270	0.31
274.0281372	0.33
275.3630371	0.76
276.2074890	1.25
277.1861572	1.09
278.9489746	0.29
280.2763672	0.29
281.3398132	1.07
282.3072510	0.16
283.5941772	0.56
285.1242371	0.63
287.3769531	0.97
289.2969360	0.91
290.9875793	2.93
291.5901184	0.05
292.3635864	0.84
293.1926270	0.88
294.6486206	1.78
295.3695679	0.40
296.0137329	0.34
297.2332153	0.27
298.1891785	0.22
299.2541199	0.40
302.1369629	0.55
303.4385681	0.15
304.2092285	1.05
305.2716064	1.78
306.5877075	1.16
307.4642029	1.36
308.2747803	0.23
309.2658691	0.68
310.3183289	0.17
312.2007446	0.39
313.1991882	0.24
315.0469055	1.01
316.3064575	0.46
317.3135986	1.24
318.1029053	0.97
319.1627808	1.86
320.2523193	0.18
321.0690308	2.80
322.4116211	0.91
323.3059082	0.70
325.0508423	0.64
326.3620300	0.45
328.3614502	0.58
329.3328857	1.45
330.3075562	1.60
331.2235107	2.82
332.4634399	1.64
333.1775513	1.43
334.3709106	0.30
335.3115540	0.41
337.3631592	1.42
338.3187256	0.28
339.2617798	0.64
340.3677368	0.88
341.2464294	2.48
342.5725098	1.28
343.2704468	2.90
344.3554688	0.67
345.3726807	3.19
346.2123413	2.03
347.6398926	0.99
348.5339966	0.35
349.4789429	0.71
350.5120239	0.54
351.3178711	0.55
353.4028320	1.18
354.1920166	0.25
355.3733521	2.98
356.3772583	1.03
357.3663940	0.91
358.1710815	0.48
358.9349976	1.64
360.2308960	1.93
361.3460693	1.47
362.5571289	0.22
363.7952271	1.20
364.5552979	0.11
365.3645630	1.31
366.2008057	0.95
367.3432007	1.00
368.3563843	0.67
369.4456177	2.69
370.2764893	0.39
371.3904419	2.68
372.1703491	0.58
373.3599854	1.75
375.3532715	1.95
376.2462769	1.20
377.1027832	1.17
378.2113037	1.80
379.3407593	1.69
381.3215942	2.18
382.8402100	0.53
383.5087891	0.99
384.4041748	1.33
385.4107056	1.04
386.5107422	1.81
387.3718262	1.13
389.3316650	1.51
390.2338867	0.50
391.5194092	1.42
392.4715576	1.22
393.4296875	0.83
395.5214844	0.30
396.4889526	0.82
397.3750610	1.04
399.3611450	0.68
400.2670288	0.46
401.5506592	1.02
402.7145996	0.72
403.4537964	2.14
404.4490967	0.63
405.4491577	1.63
406.5234375	0.42
407.4395142	1.05
409.3789062	1.95
410.3572998	0.49
412.3594360	0.26
413.4157104	0.77
414.4611816	1.06
415.4517822	2.62
416.5415649	1.27
417.4277954	2.78
418.5921021	2.31
419.5608521	2.01
420.1657715	0.26
421.4669189	0.98
422.2653198	0.59
423.2607422	1.63
424.5084839	0.31
425.2010498	0.14
426.6425781	0.87
427.5054321	2.02
428.4147339	0.97
429.6300659	2.71
430.3648071	0.17
431.4476318	3.47
432.6039429	0.77
433.4251099	1.35
434.7266235	1.04
435.5620117	1.16
436.7422485	2.10
437.4666748	0.62
438.8284302	0.47
439.5565796	0.28
440.5544434	0.44
441.5209351	1.92
442.2700806	0.09
443.5477295	0.40
444.6453857	1.80
445.4647217	1.97
446.3864746	1.58
447.4428101	3.33
448.5409546	1.47
449.4472656	0.96
450.5402832	0.20
451.7058716	0.92
452.4163208	0.71
453.4346313	1.50
454.2807617	0.73
455.4771729	4.70
456.3911743	2.42
457.2603760	1.86
458.3657837	1.36
459.4677124	3.91
460.3844604	1.23
461.3804321	3.38
462.4288330	0.87
463.4924316	2.46
465.1053467	3.20
466.2156982	1.40
467.0720825	2.24
467.6828613	0.16
468.5726318	0.14
469.5363159	0.86
470.4574585	1.42
471.4060669	4.00
472.3327637	1.19
473.5770264	3.69
474.5918579	0.73
475.4776001	3.38
476.5702515	3.06
477.7289429	1.55
478.5256348	0.25
479.7927246	0.88
480.7091675	0.24
481.3504028	0.80
483.2932129	2.51
484.3654785	2.74
485.4719238	3.33
486.5902710	2.59
487.5767212	4.21
488.4596558	2.52
489.5191040	4.56
490.4815063	2.03
491.4885864	4.33
492.6823730	0.79
493.5532837	1.88
494.8208008	1.65
495.5137939	1.43
497.4909668	2.57
498.3624268	0.23
499.4729614	1.04
500.6502686	2.46
501.5069580	3.61
502.5842896	4.76
503.4633789	1.29
504.4309082	1.14
505.4739990	4.16
506.5370483	1.27
507.6074219	2.50
508.7374878	0.44
509.6208496	0.57
510.9882202	0.06
512.1854248	0.94
513.5713501	1.36
515.4400024	2.57
516.5309448	1.04
517.4974365	2.65
518.3661499	1.54
519.6588745	1.66
521.6156616	1.62
522.6337891	0.84
523.5264893	0.92
524.8208008	1.08
525.5233765	0.75
526.5455933	0.29
527.6096191	0.98
528.6032715	2.80
529.6469116	3.34
530.6684570	0.78
531.6701660	3.05
532.7606812	1.03
533.6961060	3.27
535.5883789	0.59
536.6558228	0.30
537.4329224	3.33
538.4713135	0.19
539.7484131	1.05
541.3791504	1.84
542.5465698	3.60
543.5416870	6.06
544.5170898	1.30
545.5814819	3.20
546.5895996	1.53
547.5142212	1.92
548.4390869	1.22
549.7859497	0.52
550.7492065	1.84
551.8283081	0.13
552.6792603	0.58
553.5435181	1.37
555.2949829	2.86
556.0316772	0.71
557.5496826	3.43
558.6075439	2.07
559.4686890	1.84
560.8054199	1.93
561.6609497	5.14
562.6256714	1.51
563.4715576	3.20
564.4924927	0.36
565.8433228	1.20
566.6238403	0.10
567.5114136	0.92
568.3339233	0.32
569.5323486	1.74
570.4415894	0.39
571.4986572	5.55
572.5675049	1.79
573.7429199	2.82
574.9799194	3.88
575.8037109	1.58
576.7655029	1.07
577.8968506	2.08
578.9356079	0.19
579.5739136	0.56
580.8742676	0.14
581.6279297	4.40
582.8325195	0.94
583.7377930	2.51
584.5830688	1.71
585.5744019	5.24
586.7260132	5.58
587.6602783	3.08
588.6913452	1.50
589.6016846	2.93
590.4837036	1.31
591.6163940	3.88
592.4978638	1.57
593.5972290	3.44
594.7475586	0.10
595.4177246	0.79
596.5973511	0.41
597.5200806	1.23
599.4651489	16.50
600.6724854	8.01
601.6456909	3.87
602.7237549	2.56
603.5541382	4.71
604.4945679	1.07
605.5464478	0.95
606.6281128	0.91
607.3134155	0.31
607.9542847	0.25
609.6315308	1.08
610.7294922	1.28
611.7857666	2.02
613.4748535	1.22
614.7133179	1.78
615.4909058	2.30
616.3489380	0.57
617.5050659	28.54
618.5278320	7.09
619.5283813	4.40
620.5634155	0.81
623.8096313	0.12
625.4368286	0.22
626.6205444	0.86
628.0760498	1.52
628.8488159	2.05
629.7247925	1.90
630.5908813	0.68
631.5969849	1.10
632.7606812	0.22
633.5512085	3.36
634.5917358	0.62
635.3493652	0.50
636.6609497	0.49
637.6638184	0.20
639.4456787	3.23
640.4107056	0.40
641.7443848	0.75
643.7161255	1.34
644.6384888	1.60
646.6460571	2.80
647.5940552	1.94
648.6139526	2.19
649.6103516	0.68
650.6014404	0.24
652.6826782	0.39
653.6094360	0.40
654.8480225	0.71
655.8924561	0.95
657.8411865	0.75
659.1404419	0.33
660.8552856	0.53
661.7863770	1.48
663.5130005	0.51
665.6339722	0.11
666.2498779	0.22
667.6891479	0.37
668.7205200	0.30
669.5443115	1.64
671.6068726	7.18
672.8376465	2.12
673.7534790	0.73
674.7532959	0.73
675.8362427	0.25
676.7445068	0.83
679.3976440	0.22
681.6611938	2.42
682.9531860	1.74
683.5743408	1.35
684.8010864	0.31
685.5813599	0.41
686.6311646	0.73
687.6683960	0.99
689.5486450	15.99
690.5366211	1.60
691.5891724	3.21
693.0569458	0.18
697.5779419	1.56
699.6326294	8.62
700.7559814	2.50
701.6110229	3.30
702.6995239	0.21
704.5759888	0.92
709.7236938	20.11
710.7115479	6.29
711.3424072	0.06
713.4348145	0.12
714.4602051	0.20
715.7636108	1.66
716.8219604	1.39
717.7814331	6.63
718.8759766	2.81
719.9999390	0.13
727.5954590	100.00
728.6981812	36.69
746.0256958	0.97
748.3417358	1.91
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	303.88
Annotation	Unknow
Peak:m/z	Relative Intensity
164.3927155	0.37
170.1839752	0.57
180.0741272	0.74
198.3018799	0.40
201.0997620	0.70
218.9178772	3.48
236.7566223	0.17
257.0975952	0.95
258.2395325	0.82
260.0043945	0.45
261.4218140	0.49
262.9510498	100.00
280.9312744	22.61
283.2986755	3.31
285.1056519	1.52
286.0438843	0.74
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	353.0876
Annotation	ST077074
Peak:m/z	Relative Intensity
109.1751022	0.03
110.9915695	0.02
112.916687	0.01
126.9136429	0.06
133.2317505	0.03
133.9551086	0.03
135.1008148	0.84
136.8843384	0.01
146.0627136	0.01
154.9241943	0.02
161.1071777	0.29
170.9796143	0.04
173.1202698	0.37
179.0313873	3.68
191.0418701	100.00
214.3788757	0.01
215.0707092	0.04
221.0227966	0.02
226.7632141	0.03
232.0555725	0.01
233.0752563	0.08
249.2218323	0.01
249.9604492	0.01
262.7910156	0.03
267.1221924	0.03
269.2282104	0.05
281.3855286	0.01
295.2874146	0.04
307.221405	0.01
309.0827942	0.10
316.1262207	0.03
317.3780823	0.07
334.0755615	0.04
335.3280334	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2418
Annotation	18-Hydroxyoctadeca-9Z,12Z-dienoic acid
Peak:m/z	Relative Intensity
85.00006104	0.05
89.11224365	0.18
90.51966858	0.14
94.92942047	1.25
97.01577759	0.47
98.98283386	0.23
100.9999924	0.09
109.0960236	1.29
110.1669769	0.29
111.0061646	0.85
112.9508972	0.63
114.5811081	0.08
119.000946	0.53
121.1298828	0.96
123.0969391	1.85
129.1465759	0.26
132.2454224	0.17
133.0354614	1.07
135.0769958	1.27
136.831665	1.02
137.9642334	0.05
139.0091553	1.32
140.9338531	0.47
142.8562012	0.21
146.9952698	0.53
149.0826721	0.64
151.2009583	0.48
153.1297302	2.08
155.179718	0.78
157.1121826	0.22
158.0325775	0.11
159.1479187	0.36
160.9783936	0.64
163.1028137	0.58
165.2077484	1.04
166.9761963	0.26
169.0685577	1.27
170.1790771	0.14
171.1385956	0.53
173.2439575	0.46
175.0081177	0.95
177.2279053	0.48
178.9338074	0.21
181.3575897	0.17
183.0775604	3.55
185.0142822	0.32
187.3696899	0.88
189.255249	0.82
190.6632843	0.30
192.2778778	0.32
195.2359619	0.87
197.0367432	4.45
199.0966797	1.19
200.8201599	0.20
203.1018677	1.46
204.9220276	0.19
209.2659607	1.56
210.8191223	1.45
211.4610291	0.95
213.2874756	1.19
215.2029724	0.23
216.2746582	0.11
219.2034912	2.57
221.1368713	3.29
223.3583984	1.43
225.2543335	0.77
227.2225647	1.61
228.9827881	0.38
231.3404846	0.26
233.1738892	1.10
236.4458313	0.67
237.306488	3.21
238.6616821	1.33
239.2729797	8.60
241.182251	0.32
243.3155823	2.92
251.1915283	2.73
252.3701477	0.32
253.2393188	0.35
255.3785706	0.72
257.2484741	1.03
261.2388306	4.44
267.355957	0.07
268.3949585	0.31
269.2016602	0.48
276.432251	0.56
277.6036377	0.12
279.2323303	100.00
280.1575928	0.23
281.1098633	2.79
282.7081299	0.39
285.4776001	0.24
287.8256226	1.33
297.2344971	0.35
299.1625061	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	280.83
Annotation	Unknow
Peak:m/z	Relative Intensity
196.9382324	1.21
212.9016113	100.00
262.0284119	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	437.1711
Annotation	Unknow
Peak:m/z	Relative Intensity
129.9623413	0.95
130.8816223	0.53
145.0834961	1.54
161.9867859	1.88
178.9342957	2.83
226.2943420	1.23
243.5903320	1.49
263.9702454	1.05
274.1458435	3.45
275.2045288	0.98
291.0399475	0.69
321.6512146	1.45
322.2750244	0.72
355.3908997	2.23
363.6774292	22.06
364.4560242	12.69
371.3875732	0.21
372.7548523	12.16
373.7256775	3.66
384.4175720	0.70
390.7266846	2.13
401.1990967	0.24
405.6825867	3.94
406.2965393	1.91
407.3796082	0.96
408.6749268	1.00
415.0216370	1.65
419.2432556	3.97
421.0090942	1.21
428.2548218	100.00
428.9256592	24.19
429.6724548	0.33
453.3610229	0.57
548.1010132	2.40
566.3735352	2.41
567.5155640	0.60
582.3469849	10.31
583.4663696	3.21
599.1612549	0.69
602.4035034	1.22
651.3122559	1.78
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
199.0531921	0.06
228.9121094	0.15
245.1928406	0.02
272.9942627	7.25
274.2567749	0.02
291.0431519	0.01
314.9044800	0.04
384.9390869	0.03
387.0006104	17.33
387.6266479	0.05
402.8795166	0.02
425.1536255	0.03
451.9433594	0.04
471.0579224	0.05
483.9766846	0.02
485.0758667	0.06
485.9761353	0.02
494.2020874	0.01
500.9338379	100.00
523.8009644	0.06
531.2769165	0.02
540.1061401	0.01
540.9448853	0.03
547.9976196	0.08
559.4039917	0.04
565.8306274	0.02
567.0055542	0.05
568.0942383	0.29
569.0404663	0.27
570.0590210	0.12
571.1571655	0.14
582.0790405	0.15
583.2346191	0.11
586.0077515	0.06
597.2305298	0.16
604.9886475	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	461.1584
Annotation	Bequinostatin B
Peak:m/z	Relative Intensity
159.0547028	0.15
183.0490723	0.34
198.9811707	0.12
203.0118408	0.08
212.8621368	0.08
267.6773682	0.16
271.4550781	0.10
291.2168884	15.98
293.3894653	0.12
295.7063599	0.18
299.1413269	0.12
302.6786194	0.11
305.0139160	0.29
308.1449585	0.08
309.3786011	0.30
323.1907654	100.00
387.3742371	0.20
389.4530640	0.69
411.0924072	0.14
413.3920898	0.29
415.0303650	0.90
417.3925781	0.34
425.2384949	0.30
429.1395264	0.40
431.2445984	0.40
451.1311951	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	370.83
Annotation	Unknow
Peak:m/z	Relative Intensity
131.0116577	0.03
172.9045410	0.05
174.3612671	0.05
186.6136017	0.04
194.8452759	0.32
195.6810608	0.10
233.1096802	0.27
234.9418945	0.30
260.9533081	0.11
286.9688110	100.00
302.8413391	0.93
309.3316345	0.09
323.2885132	0.03
324.1489563	0.27
325.0462646	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	288.9367
Annotation	Unknow
Peak:m/z	Relative Intensity
86.9260483	0.03
114.9207458	0.58
130.9924927	1.99
146.9674683	0.30
159.0061798	8.83
174.8972015	100.00
200.6675110	0.03
215.1133728	0.04
216.9874573	0.06
233.0253906	0.33
235.2198486	0.02
243.1434937	0.02
244.9636230	22.73
261.0993347	0.76
262.1748657	0.04
271.0401001	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	455.1149
Annotation	Griselinoside
Peak:m/z	Relative Intensity
149.0770111	1.14
184.9744873	4.31
186.2903442	0.75
227.2103729	0.99
248.9482422	0.46
250.0217590	0.33
265.3330383	0.68
267.1378479	9.04
269.2633362	1.06
293.4723816	0.69
311.1604004	16.36
329.1454468	100.00
330.3355713	0.85
333.3960571	0.52
353.1827698	7.39
354.1101074	0.33
363.6549072	1.65
371.8277893	0.22
373.7492371	0.56
376.4867249	0.47
378.3589478	0.24
381.3175964	0.33
385.3745422	0.35
393.2575073	50.58
395.2016907	55.69
396.3864746	0.71
400.3642883	0.16
413.4764709	0.40
436.0286560	0.55
437.2588806	8.97
438.0877991	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	361.1503
Annotation	5-Deoxylamiol
Peak:m/z	Relative Intensity
137.1786499	0.61
153.3414001	0.08
154.0078125	0.06
155.1652527	32.24
173.4281769	0.06
179.0077209	0.12
179.8519287	0.07
181.1869812	0.37
185.3008423	0.02
197.2952881	0.03
199.0944519	100.00
213.2992859	0.04
223.3439941	0.09
251.2019348	0.05
253.3494873	0.07
273.5019226	0.06
287.0610352	0.17
289.4437561	0.02
299.2553101	0.10
315.437439	0.23
317.2432861	0.26
319.2171021	0.07
325.1841431	0.10
330.3140564	0.15
331.3034668	0.09
332.711853	0.02
343.2191772	3.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	584.8058
Annotation	Unknow
Peak:m/z	Relative Intensity
180.9818878	0.40
213.2449646	0.19
248.9620667	2.90
264.8080444	3.81
265.4284058	0.07
279.1532593	0.14
280.9101562	1.03
294.5703125	0.12
332.7729492	14.83
333.4221802	0.08
348.8098755	12.61
362.5320435	0.08
364.1949463	0.62
365.1914673	0.67
371.0103760	0.23
416.7515259	37.92
430.8756104	0.10
432.0758057	1.45
432.7580566	17.70
447.9531250	0.74
448.7108154	1.73
497.6965942	0.05
498.8746948	0.06
500.6914673	100.00
515.9149780	0.91
516.6506958	1.39
538.2385864	0.88
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	602.6746
Annotation	Unknow
Peak:m/z	Relative Intensity
211.0447693	0.82
215.2936554	0.05
223.1152649	0.04
241.0851135	0.90
257.0725403	0.04
262.2119751	0.05
277.0873718	0.14
279.0701294	0.11
292.8801270	0.28
294.8796387	0.03
300.8310547	0.07
308.3307495	0.03
311.0079956	0.04
323.1079102	17.40
329.1685181	0.52
334.3193359	0.26
339.4422607	0.13
359.1776123	0.61
377.0919800	0.80
379.9876709	0.16
385.4379883	0.06
391.1455078	0.15
400.7998657	0.11
406.2868042	0.05
418.9409180	0.35
420.2819824	0.11
422.8352051	0.17
426.2355957	0.05
429.0014038	7.83
429.9779663	0.03
431.1721802	0.04
432.8248901	0.05
434.7374878	0.27
437.0103149	0.02
438.0137329	0.07
440.0839233	0.50
441.1218262	5.14
444.8439331	0.16
447.2972412	0.04
449.3129272	0.13
450.8475952	0.09
452.0570679	0.13
453.0627441	0.20
462.3080444	0.05
465.1387329	0.03
466.9288940	32.64
467.9062500	0.48
470.1575928	2.69
472.8845825	0.15
483.1688843	4.60
488.1025391	0.03
488.7570190	0.04
490.0368042	0.09
491.1206665	1.04
500.2360229	0.04
505.0995483	0.04
507.2218628	0.02
515.6729736	0.20
516.8813477	0.28
518.7947388	100.00
519.8389282	0.07
520.5824585	0.14
524.0153809	0.37
531.0325928	0.02
534.8980713	6.29
542.1143188	0.13
557.1485596	0.27
560.1423950	11.89
560.7527466	0.04
568.8987427	0.57
584.1151733	0.48
585.1499634	4.59
585.7506104	0.02
592.9194946	0.07
736.7717896	0.15
752.8875122	0.07
753.9372559	0.10
754.9177246	0.05
770.6894531	0.13
798.6267700	0.15
928.7192993	0.15
934.6387329	0.14
940.6532593	0.04
958.8052368	0.03
972.2709351	0.11
985.9702759	0.03
1076.4362790	0.32
1092.5808110	0.37
1108.3298340	0.79
1109.0310060	0.09
1501.3858640	0.02
1532.5787350	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	243.174
Annotation	Montiporyne C
Peak:m/z	Relative Intensity
76.8953094	0.63
79.0323334	2.95
80.9568329	4.46
82.9100571	0.44
85.0727234	0.45
90.9708710	5.73
92.9116821	5.08
94.9360962	1.87
104.9720459	3.42
106.9159546	19.57
108.8317566	1.80
114.4256439	0.25
115.2499237	0.18
116.9824066	4.51
118.9487610	1.35
120.9798584	1.50
123.3521729	0.27
125.1604462	1.05
127.0314789	0.72
127.9993134	0.63
129.0100861	5.05
131.0270081	8.68
133.0251465	7.14
135.0246277	0.84
136.9010468	0.37
139.0765381	0.11
141.0467987	5.92
143.1610260	1.68
144.0261383	1.36
144.9604187	25.20
146.0330963	0.69
146.9862976	5.95
149.0807037	2.26
151.1013489	1.36
152.9739838	0.38
153.9565582	0.24
155.1017761	5.80
157.1644745	1.13
157.9442139	0.59
158.9999237	100.00
161.0566559	7.56
162.8806305	0.41
165.3443756	0.36
167.4898834	0.62
169.1677856	4.12
170.8090820	0.40
173.0950775	16.77
175.1176910	2.86
177.0208282	1.68
183.1454926	2.32
185.2040558	0.99
187.2519989	5.50
189.1293488	0.21
196.0296631	0.15
197.1404572	1.41
198.8800507	0.40
200.2266083	0.37
201.2307129	5.74
202.0111847	0.22
210.2657013	0.38
215.2056427	9.05
225.2228241	18.92
225.9745026	0.27
243.0159760	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	259.0919
Annotation	Ribothymidine
Peak:m/z	Relative Intensity
83.9498367	1.28
101.9584198	0.11
112.1244049	0.05
115.8054962	0.06
116.9296417	0.04
129.9207306	100.00
156.0643616	0.10
169.0736084	0.21
175.0986176	0.06
184.5846863	0.04
189.1433258	0.10
196.9845123	0.05
213.0812225	0.38
240.3666382	0.31
241.1160889	0.30
244.2940521	0.09
250.8581543	0.16
258.1336365	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	478.2917
Annotation	PE(18:2(9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
141.7284241	0.10
148.7805786	0.15
154.7805634	0.27
165.3854370	0.14
172.9427185	0.06
179.1493073	0.03
189.2619781	0.04
198.0425415	0.12
203.0089417	0.08
206.9675903	0.08
216.0708160	0.69
220.9954529	0.04
227.2349548	0.18
228.0107269	0.11
245.2677460	1.15
253.3399658	0.04
262.4266357	0.05
263.4240112	2.86
279.4250488	0.05
301.4898682	0.11
306.4164429	3.00
312.8429871	0.06
319.3646240	0.26
324.2518005	0.37
337.3226318	61.57
337.9463501	0.29
360.8462830	0.05
380.6074524	0.33
417.0848083	4.26
422.3526306	0.06
434.9587402	0.32
435.6080322	0.03
458.2689209	0.17
460.3343506	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	594.7
Annotation	Prepolycitrin A
Peak:m/z	Relative Intensity
207.0446167	1.09
274.9377441	2.60
290.4088745	2.57
291.0310669	0.75
366.9591675	0.34
381.3041992	1.90
406.3308105	1.11
424.9278564	1.21
426.6259155	8.07
428.9519043	1.40
442.7420044	14.05
457.2404175	1.32
458.3171997	0.46
458.9453735	4.81
461.2867432	1.42
507.7210083	0.84
510.6788940	100.00
526.4063110	2.56
527.0182495	0.41
547.9913940	2.40
548.8819580	5.04
571.8027954	4.44
577.4243164	1.36
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	678.71
Annotation	Unknow
Peak:m/z	Relative Intensity
206.9328461	0.38
274.8627319	1.94
290.7944031	5.46
358.2326050	1.03
358.8987427	2.91
374.7007446	1.12
426.1265869	0.50
426.8286133	9.05
442.6626587	22.48
458.7899780	1.05
470.9267578	0.56
481.0791016	0.26
499.5484619	0.17
503.8820801	0.34
505.0407715	0.26
509.2588501	0.71
510.6220703	60.86
511.3437500	0.22
512.7728271	0.96
522.9337158	1.17
526.5972900	100.00
527.2866821	0.75
538.3826904	0.24
540.6114502	0.29
542.6586304	12.53
549.0321655	0.13
572.7096558	10.35
591.9605713	0.47
594.6038208	93.07
595.3273315	0.35
610.4956665	2.38
614.7349854	0.23
619.0512085	0.40
631.3930054	0.87
632.8679810	6.49
662.3231812	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	365.0514
Annotation	Phosphoribosyl-formamido-carboxamide
Peak:m/z	Relative Intensity
90.6066895	0.02
129.0187988	0.04
135.0670624	1.03
140.8954468	2.25
146.1366272	0.03
155.2164917	0.02
159.1612396	0.07
161.3060150	0.05
166.5523987	0.06
179.0312958	15.67
181.9728241	0.03
184.9313812	29.74
186.1611023	0.13
189.2931519	0.05
202.9947510	100.00
209.8799133	0.03
219.3259888	0.06
233.3039246	0.02
235.0989990	0.05
236.0558777	0.03
245.1452942	0.05
249.3022156	0.25
259.2401428	0.09
267.1128235	0.09
269.1292725	0.02
270.8924561	0.05
274.6278076	0.07
275.3152771	0.06
277.5384521	0.03
279.0419922	0.04
294.1048584	0.03
298.4139404	0.03
301.1407166	0.10
303.2711182	0.08
304.2173157	0.15
305.1122742	0.18
307.2371521	0.08
318.0639648	0.18
319.1085510	0.33
320.1677551	0.04
321.2723083	0.17
323.4431152	0.06
328.3109131	0.09
329.1089172	0.30
337.0236206	0.24
345.0835266	0.19
346.2752686	0.50
347.2068481	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	602.8826
Annotation	Unknow
Peak:m/z	Relative Intensity
174.8689117	1.14
234.8249207	0.24
273.0244141	0.25
274.1181030	0.05
277.9899902	0.07
288.9640808	0.22
402.9647217	0.08
404.8811646	0.08
418.9111328	0.12
420.9422607	0.17
427.1832886	0.08
435.1394043	0.13
443.1319580	0.58
445.2970581	0.35
472.4442139	0.07
473.2171021	0.06
475.2539673	0.20
485.9876099	0.49
486.9832153	0.88
488.0847168	0.70
488.9610596	1.92
498.2990723	0.43
499.2697144	0.19
500.1337280	0.25
501.1176147	0.27
513.0840454	0.11
514.0654297	0.08
515.3921509	0.22
516.2028198	0.08
517.3229370	0.66
518.2302246	0.42
519.1157227	0.13
528.9459839	1.11
531.2130737	0.27
533.9678345	0.31
534.7819214	0.21
545.9929199	0.46
549.9859009	0.21
556.9828491	100.00
558.0361938	0.78
559.0679321	1.28
559.8395386	0.08
563.0687866	0.21
570.2794800	0.38
571.8330078	0.08
573.1401978	0.10
574.9450684	0.94
581.0235596	0.24
583.9166870	0.54
584.9645386	0.54
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	315.072
Annotation	4-(beta-D-glucosyloxy)-3-hydroxy-benzoic acid
Peak:m/z	Relative Intensity
92.58481598	0.21
107.9910736	8.06
109.0102234	9.34
113.0697632	1.98
118.6154633	0.52
121.0794449	2.03
123.2820892	1.12
138.1332703	0.33
145.1842041	0.37
149.0729065	0.47
151.2641296	14.61
151.9949341	33.05
153.0171204	100.00
163.1133575	11.63
165.0729065	10.80
173.1782074	0.68
178.8949432	3.45
181.1549377	3.04
183.1164246	1.22
184.0283356	0.60
193.0343018	3.19
195.056366	2.19
196.9322205	0.66
207.0207825	3.65
218.8824768	0.21
223.1617126	3.92
225.2190857	4.85
227.2684937	0.23
231.0130005	0.26
237.2445984	1.88
239.997345	0.19
241.0669556	0.56
252.3333435	0.45
254.1880493	0.48
269.210144	6.19
271.1942139	4.42
284.7131348	1.51
287.4752808	0.25
297.0596313	1.72
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.109
Annotation	Lactulose
Peak:m/z	Relative Intensity
97.0778809	0.45
101.0183563	9.09
112.9927979	18.80
115.0566940	0.24
119.0287323	17.98
125.0975647	3.25
130.8906250	8.54
143.0102844	22.64
148.9396973	2.87
160.9532166	21.31
177.6743622	0.62
178.9690704	100.00
184.1387024	0.13
221.1326294	0.10
226.3145752	0.21
245.2132874	0.11
250.8927002	0.22
263.0732727	0.22
280.9949341	3.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	588.9
Annotation	Unknow
Peak:m/z	Relative Intensity
175.1519623	0.05
230.9835052	0.17
263.1245422	0.14
273.0111389	1.95
274.0852356	1.01
275.1574097	0.47
339.0070801	0.18
358.9039917	0.31
360.4597168	0.06
361.2354126	0.04
386.8736572	0.37
388.2359009	0.55
389.2014771	0.23
390.2279053	0.04
427.2202759	1.11
428.2221069	2.02
429.0863647	2.00
430.2174072	0.11
430.8621216	0.07
442.8931885	0.49
459.0590820	0.17
473.0179443	1.73
473.9526978	1.87
475.0484009	3.55
480.8848877	0.06
484.2317505	0.11
486.2209473	0.16
487.0634155	0.71
489.4139404	0.12
501.2686157	0.26
502.2406616	0.31
503.1740112	0.22
504.1383667	0.53
514.1215210	0.09
515.1881104	0.12
520.4989014	0.30
525.7931519	0.15
526.7782593	0.05
530.1608887	0.03
541.9296265	100.00
542.8955078	71.52
543.7692261	0.97
544.7794800	1.37
545.5247803	0.03
547.8308716	0.03
548.9952393	0.06
560.3748169	0.79
560.9877319	2.05
561.9434204	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	540.1413
Annotation	Unknow
Peak:m/z	Relative Intensity
162.0009460	0.66
179.0711212	1.03
186.9935913	0.05
215.0260468	0.60
215.9656372	0.13
220.9692535	0.07
231.1521454	0.22
233.0506439	3.19
245.3753510	0.11
273.1467285	0.27
279.2027588	0.08
284.3406372	0.09
290.1684570	0.79
291.2822266	0.46
300.8403320	0.18
306.2730713	0.44
307.1911011	0.55
308.2280884	8.39
318.2604980	2.67
319.2304077	1.33
334.1772461	3.16
335.1447144	4.78
336.1267090	30.14
337.2695312	0.12
341.3660889	0.25
342.2946777	0.04
344.3563232	0.46
362.1865234	0.26
375.1744385	0.64
377.4729004	0.57
382.5282593	0.24
393.1929932	3.32
394.2893677	0.43
395.2359619	0.12
402.2816162	0.64
409.0893555	1.57
411.1768799	100.00
413.1209717	0.86
420.1976318	0.30
429.2743530	0.07
430.7991943	0.05
432.0870361	0.08
446.2355347	0.15
447.3772583	0.43
464.0238037	0.06
465.1867065	10.02
465.8161621	0.18
475.3245850	0.59
476.3237915	0.17
477.2143555	0.60
504.2944336	0.38
521.6437988	1.66
522.4089966	7.11
523.3520508	0.46
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.0931
Annotation	Erinoside
Peak:m/z	Relative Intensity
112.9930420	0.26
135.2210693	0.14
136.9207458	18.02
137.6997223	0.05
145.2144928	0.04
156.8510895	0.17
160.9402771	0.24
163.1997070	0.04
164.1512451	0.09
167.1818695	0.07
177.7936707	0.05
179.1048279	0.30
181.1501617	0.23
187.1475220	0.06
189.2039490	0.03
192.9658966	0.37
206.1522980	0.04
211.2781372	0.33
215.1374207	0.08
217.1070251	0.08
222.9883728	0.04
225.2594299	0.34
231.1108398	0.28
237.1548157	0.07
243.4302979	0.05
249.1231079	100.00
250.1517334	2.12
251.0513000	0.21
259.3341370	0.09
263.5461121	0.15
267.1564636	15.39
268.1022949	14.76
269.1371765	3.94
281.0711060	0.07
284.5761414	0.04
285.1900635	0.15
287.5866089	0.04
291.0103760	0.05
295.2643433	0.07
296.1235352	0.15
304.2649841	0.03
312.1175842	0.02
316.2202759	0.09
319.3436584	0.08
323.3343201	0.08
325.3957214	0.22
326.2910461	0.07
327.2780762	0.22
339.4281921	0.05
341.2252197	10.35
343.4752502	0.12
345.2650757	0.08
349.1268311	0.18
351.2346802	0.07
352.1089172	0.04
357.5268860	0.18
359.1781311	0.46
367.6621704	0.16
368.3628235	0.08
369.2260742	0.67
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	705.1823
Annotation	Lactulose
Peak:m/z	Relative Intensity
363.2327271	3.10
381.3616333	12.98
460.3077393	2.76
521.2446289	2.77
525.2237549	20.61
533.6907349	1.71
543.3324585	100.00
608.5493774	0.64
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
95.05662537	0.61
99.17578125	1.06
105.1162338	0.87
110.9345551	1.38
124.8625717	3.13
126.7003937	1.38
135.059021	3.22
137.1591187	0.39
139.0707855	0.41
140.2825012	0.93
151.0434265	0.71
152.8103943	0.94
154.8837891	0.37
161.2905273	0.37
165.2010193	1.14
168.2569733	1.65
171.0968018	1.86
175.1231384	0.41
177.030304	3.23
179.084259	3.12
181.1444092	0.30
183.2174988	0.30
185.2780609	0.51
187.4185638	2.08
192.2021484	0.73
193.1255341	2.14
195.1637268	0.29
197.039032	2.33
198.88237	0.72
205.342865	0.74
207.3599854	1.31
209.4797668	1.85
211.2738953	1.03
212.6395874	2.37
213.2893677	2.06
215.5131836	0.79
217.1812134	0.55
223.1321716	1.45
225.0762634	0.83
227.1928101	4.72
237.1488647	0.96
239.2997742	6.10
241.0915527	4.08
249.2984314	1.00
250.9804993	4.34
252.2086487	1.79
253.1408691	8.83
255.0908203	2.24
265.2858276	3.62
267.2653809	0.98
269.3490601	2.80
275.1870117	11.49
279.2095032	1.31
283.4369507	1.89
293.2052612	100.00
295.4513245	2.22
296.1877136	1.12
311.3510742	0.69
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	707.1821
Annotation	Patuletin 3-rhamnoside-7-(3''',4'''-diacetylrhamnoside)
Peak:m/z	Relative Intensity
288.1829834	0.13
293.4130554	0.08
353.1341553	100.00
354.2239380	0.32
355.5424805	0.05
513.1745605	0.09
515.2536011	0.37
516.6026611	0.12
545.4550171	0.29
573.5177612	0.11
609.2006836	0.04
630.3765869	0.15
640.3460083	0.05
645.2500610	0.04
661.2193604	0.18
664.3272095	0.06
671.0264282	0.22
672.3964233	0.06
675.1879883	0.21
689.5915527	0.44
690.6321411	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	786.5441
Annotation	Unknow
Peak:m/z	Relative Intensity
231.2595825	0.64
244.1912537	0.82
245.9278564	0.72
253.2046509	0.82
255.2805786	2.88
262.9929199	1.62
265.3695984	0.29
266.0843201	0.37
267.1476440	1.80
268.1140747	0.39
269.2141113	0.70
271.1440430	0.86
272.5805054	0.65
276.0599670	0.72
277.4252319	1.24
279.0706177	1.03
280.4351196	0.84
281.4049683	2.60
287.3845520	0.61
291.4676514	1.95
292.1516113	0.42
296.1166992	1.62
297.1088257	1.28
298.3551636	0.69
299.3956909	1.09
302.2585754	0.35
305.1048889	2.81
307.3602600	0.61
308.3555603	0.41
309.4068604	1.51
313.1468811	0.52
315.3116760	1.08
316.4948425	2.37
317.3848572	1.01
318.1033325	1.49
320.2981567	1.13
323.2582092	0.92
325.2731628	1.64
328.4308777	1.08
329.3518677	1.36
331.0191040	1.40
332.3051758	0.32
335.1205444	0.32
336.6720581	0.59
338.3032837	0.94
339.2306519	0.98
341.6699219	0.45
342.4747925	0.66
343.5278320	3.67
344.3781128	1.10
345.4550171	0.82
346.4518433	0.62
347.4451904	1.22
348.4548340	1.23
354.1828003	0.70
355.5023804	1.41
356.2796631	0.56
357.4469604	0.98
358.4406738	1.84
359.3530273	1.25
360.2330933	0.84
361.2316895	1.00
365.2839355	4.00
366.3372803	0.42
370.4398804	1.38
371.5032959	1.05
372.2889099	3.48
373.3969116	0.49
375.0930786	0.68
376.2130127	1.03
377.3034668	2.05
379.1975098	4.93
380.3575439	1.37
381.2828979	0.29
383.5722656	0.66
384.4515991	1.48
385.2662354	0.62
386.3435059	1.59
387.3760376	1.02
388.3007812	1.83
389.8605347	2.35
394.1408691	0.62
396.3830566	0.70
397.4677124	0.56
400.2670288	3.04
401.5349121	0.69
405.4642944	1.02
407.5052490	0.29
408.5135498	1.52
409.6076050	1.31
410.2747803	1.20
413.2476196	0.32
414.2946167	1.89
417.4074707	1.54
418.3389282	1.08
419.5166626	1.14
422.4400024	0.49
423.4912109	2.39
424.4161377	0.84
426.4794312	4.02
428.2077026	1.10
430.6239624	0.49
431.4354248	0.46
432.3637695	3.15
436.4976196	1.08
437.7435303	0.23
438.4152222	0.70
439.6286621	0.50
440.3901367	0.54
441.5737915	3.06
442.7350464	1.78
444.4846191	4.73
445.1185913	2.74
446.4541016	3.89
450.5869751	0.79
452.2147827	0.46
454.4093628	0.93
456.4740601	0.85
457.5678711	1.09
462.7976074	1.99
464.5574951	2.47
467.9426270	0.60
468.5629272	2.05
470.5723877	0.81
471.3374023	0.94
472.3386230	2.06
473.5404663	0.98
474.4003906	0.82
478.9677124	0.70
481.5399170	1.10
483.1932983	1.89
484.2656860	0.79
485.4366455	0.48
486.5579224	0.94
487.6683960	3.57
488.5070801	3.39
489.4310303	0.51
491.5643921	0.83
492.3051758	1.77
493.5977783	1.56
495.2203979	0.29
496.8439941	2.74
497.6265259	2.10
501.7268677	0.50
502.4709473	4.94
503.4540405	3.13
505.6052856	0.65
507.1817627	1.23
508.3598022	3.17
510.6317749	0.35
511.6765747	2.03
513.4879150	2.87
514.6065063	1.90
516.2726440	2.06
517.6142578	0.76
518.3927612	1.56
520.5986328	4.77
521.6080933	1.49
522.2659912	0.88
524.8151855	1.26
525.6849365	1.25
526.6329956	2.14
527.5709839	0.32
528.3675537	0.52
529.6691284	2.33
530.4466553	2.00
531.4709473	2.79
532.8457642	3.34
534.7618408	0.75
535.6940918	1.23
536.5776978	0.74
538.6386108	0.95
539.6190186	0.64
540.8200073	0.38
541.8183594	0.83
542.6375732	0.43
544.4447021	10.04
546.1002808	2.56
546.7769165	2.23
547.9082642	1.36
550.4354858	0.59
551.6454468	1.40
554.5269775	1.31
555.7631836	0.38
557.4896851	3.34
559.0085449	2.80
560.7216187	3.17
561.6757812	0.63
562.7411499	0.69
563.3948364	1.02
568.1592407	3.86
568.7803345	0.32
570.3842163	1.71
571.6549683	2.17
572.7468872	0.61
573.6979980	2.95
574.5850220	1.98
575.1933594	1.25
578.3091431	0.32
579.2808228	0.82
580.8032837	0.85
581.5169067	2.41
583.8300781	0.78
584.4678955	0.83
586.8952026	0.69
589.6647339	0.65
590.4089966	0.40
592.8971558	2.12
593.8396606	1.82
594.9206543	1.42
596.5127563	3.52
597.5269165	1.79
598.6793823	6.76
599.5911255	0.55
600.4640503	1.16
601.6876831	3.98
602.7451782	1.64
603.9055786	2.40
604.6046143	0.48
606.5728760	3.77
608.6626587	1.20
610.3990479	0.78
612.3984985	3.09
614.7723999	2.99
615.6295166	1.27
616.7289429	1.57
617.6798706	2.22
618.8677368	1.54
620.8068848	1.50
624.8274536	0.26
625.5822144	2.19
626.8743286	0.63
628.4901733	2.26
629.5322876	0.96
630.9550781	3.20
632.5757446	5.73
633.8090210	0.42
634.5913696	0.61
635.5358276	0.45
640.6063843	12.13
642.4762573	1.87
644.4978638	6.15
646.7612915	1.07
651.5567017	1.75
653.7840576	1.10
657.3339233	3.14
658.5947876	30.66
660.4791870	4.13
661.7136841	1.96
664.9514160	0.33
667.7204590	1.02
668.6627197	0.83
670.9174194	1.06
671.9529419	0.73
674.6134644	3.09
678.4636841	1.10
680.2490845	0.41
683.7036743	0.45
684.7836304	1.37
685.4794312	4.36
686.5443115	0.82
687.3445435	1.25
688.5505981	9.58
689.3406982	1.34
691.6619263	0.26
692.4937134	1.22
694.7727661	0.52
699.9532471	0.47
700.7625732	0.81
701.6489258	3.46
702.6173706	1.02
704.7211304	0.38
707.3544922	0.73
709.2924805	3.88
709.9349976	0.60
711.0100098	1.05
712.6870728	9.03
714.9757080	1.27
716.0203247	2.78
716.7454834	0.78
719.8009644	1.33
720.9602661	1.62
722.8770142	2.48
727.4843750	10.35
728.0947876	0.55
728.7088623	1.05
729.6045532	1.94
730.5335083	29.22
732.9780884	1.60
739.0552979	1.31
740.5650024	6.19
741.7625732	0.95
745.1482544	1.12
745.8398438	4.17
750.7957153	5.63
751.7214966	1.54
756.5065308	8.06
757.4962769	1.66
758.7297974	11.92
768.5220337	100.00
769.2570801	1.48
769.8839722	3.72
771.8966675	1.48
774.2378540	0.24
783.7799683	0.45
786.6934204	1.81
787.6251221	1.13
789.3713989	2.74
792.6245728	3.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	562.8
Annotation	Unknow
Peak:m/z	Relative Intensity
190.9352112	0.18
206.9584503	0.28
258.9824829	1.43
274.7994080	4.02
290.9003296	1.11
297.4650879	0.26
342.6128540	1.47
358.9643555	0.40
386.1905518	0.26
388.0394897	0.41
393.3656616	0.13
394.7045288	1.69
397.9757690	0.79
408.5765381	0.54
410.6855469	22.58
411.2894897	0.48
426.2274780	6.13
426.8649292	24.67
478.8029785	100.00
494.7688599	34.14
516.1049194	1.78
541.3131104	0.85
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2419
Annotation	Moniliforminol A
Peak:m/z	Relative Intensity
93.20413208	0.15
94.97470093	0.45
97.01108551	0.76
99.11730957	0.28
100.6045685	0.22
107.1307678	0.37
108.9403534	1.56
110.9346466	0.53
112.796051	0.53
114.0682373	0.20
121.0607758	0.31
123.0972137	2.43
124.8421478	0.17
129.0193481	0.46
133.2056274	0.53
135.0320129	1.69
136.9948425	0.71
138.202652	0.08
139.0155792	1.82
141.0781555	1.68
144.9535828	0.25
147.3730164	0.38
148.0975952	0.11
149.0132141	0.83
151.0290222	0.20
153.1109619	1.47
154.9036102	0.94
157.1671448	0.83
159.0892029	0.11
161.20224	0.25
163.0793304	0.94
164.9473267	1.01
166.9168701	0.79
169.0429077	1.73
171.0519562	1.23
173.1594238	0.19
175.3013306	0.24
176.9203491	0.08
179.1868591	0.39
181.0740814	0.99
182.0466156	0.43
183.2020264	3.62
185.1861572	1.17
186.9618835	0.11
189.2100677	0.64
191.0211029	0.49
193.1126404	0.47
195.2084351	0.77
197.0727997	3.59
197.7714233	0.51
199.1422119	2.03
201.2678528	1.19
203.2350159	2.06
205.0440369	0.07
207.2051086	0.43
208.197998	0.22
209.1269226	0.63
211.1464539	2.88
213.1278687	0.97
215.083252	0.44
217.2744446	0.52
219.1869812	1.14
221.2253113	2.03
222.1809692	0.26
223.1918945	1.12
225.2596436	1.15
227.1694946	0.76
229.3484192	0.12
233.1022034	1.77
233.7304993	0.19
235.4561462	0.11
236.2245789	0.17
237.2028503	4.31
239.2025146	10.61
241.3701782	1.04
243.2806091	1.19
249.2227783	0.17
251.2473755	2.47
253.3133545	0.30
254.9960022	1.92
255.6129456	0.10
256.83078	1.53
257.434021	0.09
259.5389709	0.14
261.1751099	3.39
262.307251	0.15
265.2980042	0.11
269.3147888	0.09
279.2294922	100.00
279.8621826	0.24
281.9813843	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	323.13
Annotation	Nordurlettone
Peak:m/z	Relative Intensity
75.9660339	0.03
102.9356842	0.28
104.7645874	0.50
108.9820251	0.30
114.9685287	0.79
121.9521942	0.10
129.0713806	0.41
131.0000916	0.19
133.0099487	2.14
133.6244354	0.05
137.0436554	3.94
138.9130859	0.19
140.9061890	0.14
142.8374023	0.21
145.9531708	0.69
149.1706848	0.46
151.0201111	0.17
153.0709381	0.18
159.1641541	0.17
161.0331726	62.80
162.3163605	0.08
163.0917511	0.05
165.2233887	0.11
167.0276794	0.31
171.1251221	0.08
171.7550659	0.05
173.0738983	0.31
175.1644592	0.69
181.0640564	0.47
183.9110260	0.18
185.1164551	0.04
187.1334991	0.30
189.0480042	0.08
191.9779968	0.12
195.1451263	0.10
199.1482391	8.42
201.1990814	0.08
206.6775208	0.08
211.2836304	0.07
213.0638428	0.24
218.2093201	0.06
221.8649902	0.04
226.8467712	0.04
231.1452332	0.90
234.1363220	0.06
235.0238647	0.11
240.0911560	0.06
245.3358459	0.58
247.2806396	0.11
249.2961426	0.48
252.0264587	0.07
253.0232239	0.39
255.2232666	0.42
259.1544189	5.81
260.0915527	0.69
261.2399292	0.23
263.1906738	2.34
264.0272827	0.07
265.0632324	0.21
267.3533020	0.43
272.6508484	0.11
273.4651794	0.48
276.2557373	1.16
277.3020020	0.48
279.2680969	0.16
280.0783081	0.14
281.2985535	0.12
287.0498047	0.22
291.1187744	100.00
292.2689209	3.27
295.2579651	7.90
299.5817261	0.22
304.2631836	0.76
305.3247375	1.44
308.2924805	1.74
312.9691162	0.15
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
176.0270996	0.11
229.7713318	0.08
231.2819519	0.06
245.0265503	0.07
273.1277466	1.34
273.9655457	0.84
274.9484253	1.11
289.0093994	4.62
290.1131592	1.28
291.0625000	1.12
387.0502319	1.49
388.1251221	1.84
389.0944214	1.40
402.9953003	15.36
404.0222168	13.75
405.0338745	7.90
487.0163574	0.02
501.8181152	0.67
503.0576172	0.48
516.9367065	49.26
517.9341431	100.00
519.0062256	72.86
522.3792114	0.20
557.7682495	0.06
559.2601318	0.07
586.1052246	0.44
587.2536621	0.21
588.0739136	0.04
589.1386719	0.50
600.0112305	0.15
601.1682739	0.07
605.1580200	0.13
606.7783813	0.21
623.2893677	0.07
633.2138062	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0854
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
77.93695831	1.04
90.76304626	2.55
103.1678925	1.55
105.0342865	1.10
106.9855347	2.83
109.0521851	0.85
118.6664124	1.35
122.9790649	1.00
125.02565	0.43
129.0869141	6.56
132.9202118	0.48
135.0831757	4.62
137.0989532	1.63
147.208313	1.25
151.0509796	100.00
151.9869995	1.84
155.1300812	0.61
160.9966583	2.43
163.1478424	0.66
165.0347137	2.86
167.1904449	5.49
169.0040741	2.20
171.1691284	2.83
175.1338501	3.25
176.9729462	1.62
179.0172577	0.62
181.9779968	3.30
185.4308624	3.99
195.0009308	1.98
197.1741486	12.58
198.0823822	0.97
209.1499329	2.35
217.4214935	1.54
225.2547302	8.57
235.3325806	9.56
238.1434174	25.18
239.1114044	1.59
251.2810669	2.40
253.0824738	94.34
254.0095215	1.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	377.09
Annotation	Lactulose
Peak:m/z	Relative Intensity
112.8170547	0.03
179.0414581	0.61
197.1053162	0.47
215.1435242	9.15
289.3026428	0.10
341.1694641	100.00
358.2888184	0.03
359.1137695	0.07
359.9030457	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	237.06
Annotation	8-Dehydro-3-deoxy-D-manno-octulosonate
Peak:m/z	Relative Intensity
99.0286407	0.38
112.8434448	0.50
146.0082855	0.98
149.0518188	0.46
150.1258698	2.38
160.6171265	0.30
164.0677795	0.86
165.0720673	0.66
166.9486389	1.49
169.0882416	1.02
170.1470947	1.94
172.9911346	0.62
175.1391754	1.45
176.6774597	0.78
180.1554413	1.36
185.3634796	0.68
186.9085083	23.14
188.8509064	0.42
190.2637177	1.73
191.1864777	4.29
192.0773163	2.37
195.1600189	2.74
199.9826355	0.62
201.3695221	0.90
202.7879791	1.89
204.7028198	100.00
205.3362274	0.44
209.0888519	2.78
214.1296234	1.95
218.9607544	5.49
220.1314240	1.99
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	277.0331
Annotation	Unknow
Peak:m/z	Relative Intensity
78.9977875	6.17
96.8464203	100.00
100.9857330	0.70
112.9874649	0.18
127.7852173	0.10
149.0349884	2.77
150.6880798	0.19
151.3034973	0.16
161.2163086	0.46
178.9752197	1.15
187.3393860	0.14
197.0863037	0.59
204.3400269	0.12
209.1423950	0.19
215.3601379	0.16
216.2151794	0.24
217.2330627	0.25
220.9400635	1.37
221.9358826	0.16
228.2793579	0.39
230.9240723	0.24
232.8710632	0.10
239.1291504	16.57
240.1093445	0.26
241.1011658	3.92
249.2818298	0.10
258.1594238	0.46
258.9226074	0.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	353.0877
Annotation	Scopolin
Peak:m/z	Relative Intensity
110.9443665	0.02
127.0738983	0.02
133.1113434	0.02
135.0815277	0.52
139.7982635	0.03
141.1210938	0.03
142.9525146	0.11
149.1676636	0.03
155.0284729	0.04
161.1410675	0.41
170.9744568	0.04
172.9943085	0.20
179.0792084	3.99
188.8903198	0.02
191.0480042	100.00
195.0614014	0.04
203.0746002	0.03
204.8485718	0.01
206.9020233	0.09
209.2320557	0.03
220.8769226	0.04
229.1890564	0.02
231.2440796	0.02
232.9257507	0.08
253.2743530	0.05
261.4108887	0.08
262.9751587	0.04
273.2113037	0.25
279.2445068	0.12
289.2773438	0.11
291.0764160	0.15
292.4418945	0.03
293.0914001	0.12
307.1399536	0.61
308.1000366	0.07
309.2855225	0.07
311.4425354	0.02
317.0715637	0.01
332.3476868	0.04
333.4587402	0.08
334.0891724	0.03
335.2210083	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	421.0026
Annotation	SC-58125
Peak:m/z	Relative Intensity
129.0993347	0.16
155.1008301	0.22
171.1518555	0.15
172.9119873	1.64
191.0045776	100.00
193.0364532	0.07
211.3162689	0.07
213.0996094	0.06
241.1022949	0.04
246.0959473	0.05
254.7504883	0.10
258.9070740	0.15
273.0517883	0.30
274.1148682	0.05
286.1830139	0.04
288.1735229	0.08
289.1122437	0.13
290.8446655	0.03
298.9310913	0.05
302.5717773	0.10
306.4555359	0.07
315.1908569	0.65
316.0412598	0.84
317.0539551	2.41
324.0610962	0.07
332.8699646	0.15
358.1065979	0.05
359.0421448	0.10
360.0622559	0.09
385.0091248	0.35
402.3141174	0.47
403.0932007	3.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	343.1228
Annotation	Unknow
Peak:m/z	Relative Intensity
260.0065308	2.85
289.1223755	5.31
323.5263672	3.61
325.0870361	100.00
326.1381836	26.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	344.1391
Annotation	Chondriamide B
Peak:m/z	Relative Intensity
109.8867798	0.19
119.9631500	0.17
121.8345566	0.13
129.9934082	1.44
134.0409698	0.11
137.1451721	0.25
144.6764221	0.32
149.1684265	0.28
152.9694519	0.20
162.0789185	0.09
168.8826752	0.21
172.1632538	0.33
174.2029877	0.36
179.0464172	0.30
182.0083466	0.13
193.0949860	0.10
194.2748260	0.09
195.0247955	0.15
200.2435913	0.23
220.9174500	0.34
226.8101501	0.45
231.1645508	1.14
237.3464050	0.12
241.5752258	0.21
244.6821289	0.32
247.2745972	0.74
249.2705078	0.46
254.2297363	0.54
255.2695923	0.36
256.3531189	0.07
258.3110962	0.57
262.6389771	0.40
268.5257568	0.32
271.2191162	0.71
271.8247681	0.66
275.2768860	0.25
276.0611267	0.12
277.1099854	0.10
279.5256958	1.39
281.1626587	1.42
282.4400024	0.41
283.4520264	0.87
284.6956177	0.51
285.9540710	0.43
288.0572510	0.18
290.0045166	0.22
291.2684937	0.70
295.1315613	1.40
296.2041626	0.23
298.3700562	1.30
299.6279297	100.00
300.2788086	8.27
301.1345520	0.11
302.2349243	0.19
303.2696533	0.62
306.6283875	0.21
308.5648804	0.49
309.2534485	0.32
310.2504883	0.30
311.1857605	0.96
312.7574768	0.55
313.4425354	0.62
321.2340698	0.37
324.1685791	0.18
325.3700562	6.92
326.3074646	5.23
327.2380371	1.84
330.0353088	0.17
335.3526001	4.30
336.2741089	0.68
338.5995178	0.20
343.7798157	0.13
348.3775940	0.14
375.5110779	0.14
378.2767334	0.69
380.0223083	0.10
419.3929749	0.25
420.5509338	0.39
432.1091919	0.18
438.0341187	0.92
439.2193298	0.48
451.4891052	0.89
453.1971741	0.23
455.3150940	0.59
456.6293335	0.32
478.4067993	0.28
491.2773132	0.56
494.6409302	0.43
498.1836548	0.14
521.4028931	0.35
523.1812744	0.22
540.2009277	1.77
541.3829956	0.41
546.2869263	0.14
548.5122070	0.53
558.3737793	0.91
566.6655884	0.98
568.1514893	1.43
569.4542236	0.72
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	447.2233
Annotation	L-Linalool 3-[xylosyl-(1->6)-glucoside]
Peak:m/z	Relative Intensity
131.0615845	1.11
131.8563538	0.24
143.0284119	0.91
144.0663452	0.32
145.2675018	0.06
148.9890747	1.48
150.1916656	0.05
159.0912781	2.99
159.9136658	0.06
161.0244446	33.16
162.0317688	3.20
179.1378479	0.43
180.1421509	0.08
191.1662598	0.44
193.1808014	0.10
197.2681274	0.07
211.3615723	0.07
219.0933380	0.07
220.8486481	0.09
233.0379181	1.16
234.1023407	0.27
250.6291809	0.18
275.0421143	0.15
279.5632629	0.20
293.2224731	1.72
296.1837158	0.17
297.4705200	0.36
301.1672363	0.22
311.1230164	0.10
315.2231445	100.00
316.2821045	30.60
326.3188782	0.14
339.4295654	0.09
356.2799683	0.05
357.3343201	0.53
358.4578857	0.57
362.1191101	0.13
369.2764893	0.17
387.5458069	0.07
402.4356079	0.43
404.0546265	0.40
410.1584167	0.21
411.2601624	0.42
412.1465149	0.13
429.6713867	0.87
430.3222351	0.77
431.5159302	0.46
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	683.2253
Annotation	Citbismine C
Peak:m/z	Relative Intensity
203.2006683	0.11
341.1939697	100.00
385.1204834	0.06
491.4265747	0.04
511.1363525	0.04
511.7690430	0.16
617.2848511	0.26
622.0409546	0.09
637.0482788	0.29
647.3384399	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	363.1641
Annotation	[3R-(3alpha,3aalpha,4beta,5alpha,6aalpha)]-3-[(beta-D-Gulucopyranosyloxy)methyl]hexsahydro-4-(hydroxymethyl)-5-methyl-2H-cyclopenta[b]furan-2-one
Peak:m/z	Relative Intensity
105.5660706	0.19
152.9511719	0.10
154.9496765	1.55
164.9383545	0.71
173.8926697	0.31
182.9209747	8.73
200.9064636	7.16
230.1312866	0.82
246.1876526	0.08
263.3522644	0.41
281.2713013	0.79
309.2269287	0.09
310.2451477	0.40
320.2897949	0.26
325.6021423	0.70
327.2345581	1.89
343.5229797	0.47
345.1898499	100.00
353.9832764	0.87
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	308.0902
Annotation	Glutathione
Peak:m/z	Relative Intensity
115.8703842	0.91
117.0354462	0.29
119.1070023	0.04
129.9855957	0.25
131.0628052	0.22
143.9949188	2.16
145.0037231	1.18
145.9317474	0.16
146.9264221	0.03
150.0332336	0.04
150.8319397	0.08
161.9531250	23.48
163.0059357	8.72
171.3398743	0.02
174.8970490	0.04
178.9582214	100.00
180.0543823	39.88
188.0054016	0.06
193.0684967	0.05
215.1088257	0.48
216.1024780	0.47
233.0447083	13.07
234.1181335	9.88
245.0157776	1.07
246.1684875	1.05
249.0455933	0.10
263.2329712	0.15
272.1804810	1.29
273.2305908	1.15
290.0902100	4.30
291.1364136	4.79
292.1779175	0.73
296.2243042	0.25
300.4409180	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	615.1867
Annotation	trans-delta-Viniferin 3''-glucoside
Peak:m/z	Relative Intensity
172.1441345	0.37
173.2008514	1.08
173.8513489	0.63
175.2522430	0.11
177.0667572	0.69
187.1583099	1.87
188.1680756	0.64
189.0960541	1.85
191.3773346	0.21
192.2699738	0.28
201.1714478	1.31
202.2375641	0.34
203.0854797	0.74
204.3154602	0.06
213.3993530	0.19
219.2000732	0.15
223.1879120	0.23
235.0562439	0.27
235.9522858	0.13
237.0968323	0.17
243.0956116	0.15
246.8200836	0.09
247.4486542	0.10
251.1499634	0.34
254.1789703	0.46
255.1018677	0.24
257.3476257	0.34
263.2124634	0.41
264.0190430	0.59
265.4555054	0.12
266.1370850	0.15
267.3136597	0.14
269.1874390	1.65
270.2362976	0.20
273.2958374	0.14
275.2997742	0.51
276.0698853	0.59
277.1009827	0.09
278.2243042	0.25
279.1160889	1.85
280.1507263	1.68
281.2046814	1.04
282.2397766	1.29
283.0496826	0.32
285.4658203	0.16
290.4413452	0.42
291.2200317	0.86
292.0808105	1.06
293.2169495	1.27
295.0921631	4.92
296.2520142	0.57
297.1336975	0.93
305.1216431	0.13
307.3061523	2.42
308.2489014	0.50
309.2518616	0.87
310.2698364	1.72
311.2802734	4.86
312.8579102	1.62
313.6018372	0.28
314.4775391	0.13
321.2287292	0.08
324.1037903	1.55
325.2477417	29.95
326.2711182	4.59
327.3305664	1.30
328.3076782	0.16
339.1817627	2.65
340.3348999	0.23
341.2772827	0.84
342.4132080	0.19
343.4395142	1.88
353.2028809	0.14
357.2469482	0.59
358.3992920	0.20
359.1240845	0.14
360.9723511	0.19
375.5225220	0.39
409.1156616	0.21
414.3853760	0.12
415.3913574	0.64
429.3473511	1.01
438.9661255	0.07
448.2666626	0.12
449.1556396	0.44
459.2416382	0.60
462.7269287	1.05
463.3988037	2.01
464.5447388	2.28
465.2976074	3.88
466.3015747	1.24
467.3180542	0.09
477.3240356	13.49
478.2641602	4.28
481.6511841	0.09
495.2836304	100.00
496.3640137	27.49
497.4391479	0.11
501.6040649	0.09
524.1767578	0.33
526.0466309	0.26
570.4450073	0.10
571.3209229	0.29
579.3760986	0.17
582.4926147	0.08
583.0975952	0.44
600.2648315	11.70
601.3595581	5.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1089
Annotation	5-O-(alpha-Mannosyl)-myo-inositol
Peak:m/z	Relative Intensity
101.0958557	1.14
110.9234314	0.77
112.9325714	28.99
118.9936066	14.63
125.1187439	0.68
125.9747772	1.13
131.0292511	6.97
142.9942627	19.36
145.9601898	0.88
149.0380249	10.55
152.9733429	0.98
155.0281982	2.59
161.067627	19.28
162.818512	2.65
179.0491486	100.00
183.9035187	0.75
191.5048828	0.89
192.1110229	2.00
192.9098358	2.95
195.0731506	4.24
198.0931396	0.98
199.3396912	0.88
200.9184723	1.38
209.1897583	1.47
214.745697	1.34
217.2424622	1.87
221.1708679	2.51
223.0570984	1.01
227.0918579	6.98
235.0024109	1.41
237.2061157	1.14
253.0269165	2.24
261.369812	1.27
267.3448486	2.82
269.1666565	4.77
273.0344238	4.33
281.0384521	6.15
284.3587952	0.75
294.8800659	11.45
297.2646179	26.23
303.0880127	1.01
305.0298157	3.19
307.3692932	1.34
310.508667	2.10
311.5556641	2.03
312.2594299	0.88
323.2492371	20.18
324.2771912	0.88
325.2692871	3.48
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	379.08
Annotation	Lavendamycin
Peak:m/z	Relative Intensity
112.6580811	0.09
142.9773560	0.04
161.2178345	0.05
162.0742493	0.08
179.0354919	1.12
180.1470337	0.07
181.3215942	0.02
197.0002441	0.19
199.0713654	0.48
215.1439819	2.08
216.1140900	2.22
217.0211334	9.21
250.9063110	0.03
341.2100220	100.00
342.1744995	37.75
343.2214966	8.64
343.8445435	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.109
Annotation	5-O-(alpha-Mannosyl)-myo-inositol
Peak:m/z	Relative Intensity
97.00012207	0.17
101.0174255	4.20
112.9178009	17.28
118.9530106	11.20
124.8040619	0.38
131.054657	5.28
143.016861	16.29
149.0585327	1.07
161.0601501	24.46
179.0517273	100.00
189.0808716	0.21
191.1342621	0.29
209.0412292	0.40
221.0456848	0.42
249.0940247	0.36
251.29599	0.43
280.7758484	1.27
295.3465576	2.76
321.0699768	0.88
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	203.0827
Annotation	Ethotoin
Peak:m/z	Relative Intensity
68.9801407	0.43
70.9150238	0.07
71.9358520	0.38
72.9513702	0.06
73.8914261	0.74
78.9684753	0.15
86.9805145	0.18
97.0239258	0.64
112.9636993	0.16
115.0251770	0.34
115.9793396	31.29
116.9431458	0.10
118.1320343	0.07
128.0659637	0.40
129.0993500	0.57
130.1157684	0.99
131.4479523	0.06
132.1036682	0.33
140.9746552	1.12
142.0854187	12.17
143.0982513	0.08
156.3046265	0.04
157.1745148	0.13
159.0060730	100.00
161.2184296	0.04
167.0588379	0.17
173.0115509	2.83
185.3313446	1.19
186.1809692	9.92
187.0762482	0.24
199.3512421	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	455.2398
Annotation	Vibsanin G
Peak:m/z	Relative Intensity
170.8652039	0.63
203.0145874	0.90
281.7911987	2.66
355.2940063	100.00
361.3763123	0.51
405.9952393	0.83
409.5017395	2.42
414.0272522	1.14
424.2865906	1.87
435.8810730	0.93
441.0370178	0.62
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	354.0844
Annotation	Unknow
Peak:m/z	Relative Intensity
94.8517609	1.24
104.0394592	2.63
132.9692383	16.15
145.9717560	0.59
150.0191498	100.00
173.9695129	0.62
175.1492157	1.71
178.9509125	0.35
179.9570923	0.32
220.6009521	0.99
227.3108215	0.45
232.0879822	0.39
240.3013000	1.34
251.8732910	3.66
258.1098633	0.76
309.2277832	0.45
336.1722412	1.69
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	220.1174
Annotation	Pantothenic acid
Peak:m/z	Relative Intensity
69.1308289	0.06
71.9384918	1.64
73.7169113	0.04
89.9433136	25.56
98.0296326	0.02
100.0084229	0.03
115.9327240	2.68
118.1522675	0.04
124.1576233	0.12
130.8270264	0.33
142.0609283	0.06
149.1955109	0.07
154.1843414	0.05
156.1497345	0.66
160.1488037	0.13
164.2334442	0.04
166.0779266	0.71
171.7862091	0.24
172.7460480	0.15
174.0548859	3.71
174.6852570	0.09
175.9033051	0.10
178.9757538	0.13
184.0672760	24.85
192.2319794	1.32
195.4942474	0.15
202.0579987	100.00
210.6970673	0.50
211.5367737	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	584.8
Annotation	Unknow
Peak:m/z	Relative Intensity
180.8031311	0.22
249.0383911	2.91
264.8996582	2.04
271.1078491	0.14
281.1705933	1.42
332.0910645	1.62
332.9971924	11.73
348.2839966	0.74
348.9409180	5.94
364.6824341	0.71
371.1870117	0.93
377.0898438	0.31
415.5211792	0.71
416.7700195	25.56
422.7025757	1.22
432.5897217	8.95
478.7847290	1.01
479.4442139	0.81
498.7409668	0.20
500.6443481	100.00
501.5194702	0.31
508.9797363	0.55
516.3674927	0.20
517.1618042	0.42
520.5358276	0.69
524.6935425	0.64
538.1423950	1.98
538.9155273	9.38
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	175.12
Annotation	5-Methyltryptamine
Peak:m/z	Relative Intensity
59.94467163	34.96
69.97619629	4.52
71.94010925	1.13
87.01150513	0.18
88.1685791	0.13
96.85614014	0.28
97.92248535	0.32
111.9224396	4.24
112.9536896	1.08
114.0326996	3.43
115.991684	52.70
130.0643616	35.97
131.2221222	0.22
133.001709	1.19
134.0661011	0.07
140.0529327	2.91
141.1193085	0.08
147.1491852	0.18
151.1392365	0.22
154.1307831	0.11
157.0727997	85.97
158.0909882	100.00
159.3315125	0.06
166.1665192	0.35
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	329.0876
Annotation	1-O-Vanilloyl-beta-D-glucose
Peak:m/z	Relative Intensity
107.8821106	1.65
117.8794861	0.13
123.0837936	1.63
125.0430908	0.65
152.129364	3.05
164.1429443	0.36
167.0406494	100.00
172.8915253	0.25
181.0680847	0.29
201.0560913	0.26
201.8569183	0.52
209.1015015	0.75
213.0515137	0.57
223.9374695	0.40
227.0680237	0.44
232.9579773	0.70
234.9414368	0.43
237.0802612	0.61
239.1239624	0.32
241.0728149	0.33
244.4502563	0.40
245.1834106	0.24
267.2808533	0.86
281.8683472	0.24
283.1877136	1.90
284.5257568	2.17
285.2587585	1.11
293.0671082	3.32
295.4545593	0.28
309.1553345	0.77
310.8413696	1.80
311.6033936	0.76
314.229248	0.59
328.9818115	0.58
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	280.9927
Annotation	Unknow
Peak:m/z	Relative Intensity
146.8909302	0.28
204.8526611	0.41
219.0480957	0.19
234.0950317	0.34
237.4592285	0.22
239.8703308	100.00
250.2798767	0.10
252.9680786	0.33
255.4496155	0.25
256.0942383	0.14
257.7392273	2.91
260.2321167	0.81
263.2749634	0.44
272.1253052	1.51
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
84.8962479	0.02
95.1670380	0.04
96.8722458	0.48
98.9831924	0.05
108.9297333	0.34
114.4506760	0.10
116.7627106	0.04
126.9715958	4.41
129.0614166	0.05
135.1043701	0.12
139.0110321	0.12
144.9290161	6.87
157.1185913	0.02
159.6936035	0.07
162.8460083	11.61
165.0878754	0.23
172.8283081	0.08
177.5292053	0.02
181.2193909	0.29
183.0436401	0.06
184.4142456	0.02
186.8859100	0.06
189.0686951	0.06
191.1129761	0.09
192.8482819	0.78
194.8802795	0.16
196.9517517	0.05
199.0546570	0.68
202.9153595	0.04
204.5278320	0.12
205.1488037	0.32
207.0842590	0.09
211.0278015	1.17
212.2857056	0.09
217.0163879	1.97
218.3396606	0.03
219.2532959	0.11
221.2225037	0.04
222.9201050	2.73
223.6101685	0.05
225.0408325	0.50
229.0037231	1.07
230.6750488	0.03
231.3610229	0.05
232.7910156	0.02
234.9139404	0.57
239.4212952	0.04
240.1227722	0.05
240.9593811	0.70
241.5959167	0.01
242.9619141	0.35
247.0017090	2.47
251.0830078	0.07
253.0551453	7.15
254.3474121	0.03
256.1075439	0.06
258.2081299	2.90
258.8491211	12.21
259.5974731	0.04
261.1413574	0.33
268.1637573	2.79
269.2419434	0.69
271.0894165	21.45
272.2163086	0.05
275.9978333	0.17
276.8764038	0.14
278.9027710	0.45
279.9289551	0.05
282.2203979	0.03
283.5758972	0.09
286.1146851	0.74
287.1677856	0.76
288.8518066	100.00
289.5966187	0.21
299.3410645	0.02
302.9357605	0.11
303.7254028	0.02
304.5126343	0.02
306.9691772	6.97
308.2985535	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	343.1225
Annotation	Unknow
Peak:m/z	Relative Intensity
180.8959961	2.78
195.1451569	0.75
270.9152222	1.15
289.2155762	2.35
324.9820557	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	565.1923
Annotation	Fraxiresinol 4'-O-beta-D-glucopyranoside
Peak:m/z	Relative Intensity
189.1321411	0.32
206.9874573	0.98
221.0345154	0.06
277.2395020	1.05
287.1273804	0.20
307.4777222	0.10
309.2547302	0.46
313.4237671	0.08
317.3853149	0.14
324.2230835	0.17
325.2152710	0.10
327.2376709	54.59
328.2277222	8.14
339.2404785	100.00
340.3492432	12.42
352.9358521	0.10
355.5173950	1.24
356.2303467	3.02
356.9459229	22.15
357.8917847	2.44
359.1938477	0.19
361.3568726	0.05
375.3028564	0.07
385.2487183	0.22
403.5064697	0.13
421.3773193	0.11
422.0694580	0.04
431.3813477	0.09
433.3372803	0.30
437.4042969	0.17
445.2111206	0.12
449.9050903	0.27
460.9483032	0.24
465.4623413	0.22
480.4394531	0.22
484.3028564	0.15
485.1441650	0.16
504.5733643	0.45
505.3015747	1.79
506.1105347	0.46
518.7011108	5.85
519.6232300	2.37
520.7495117	0.41
521.4082031	1.38
523.3629761	0.08
528.3849487	0.08
529.2557983	0.24
530.1855469	0.16
547.5903931	0.25
548.7501831	0.50
551.1688843	0.05
564.9785767	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1088
Annotation	Galactinol
Peak:m/z	Relative Intensity
96.90042877	0.33
98.85297394	0.78
101.0719681	5.14
106.8042603	1.26
113.012825	12.90
114.698555	1.82
119.0356903	19.15
125.0088959	2.00
130.9870453	8.24
137.1707764	0.30
143.0171509	24.32
149.0111084	1.29
160.9720764	25.85
171.2950287	0.20
179.0475464	100.00
221.1940002	1.54
243.1725464	1.97
265.28302	0.29
274.3493652	0.48
278.1620483	0.57
281.2689819	1.75
295.1706848	4.60
297.1095581	1.05
304.252594	0.22
312.9441223	0.36
322.1315918	0.19
323.2341919	0.93
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	503.1901
Annotation	Limonexic acid
Peak:m/z	Relative Intensity
146.9480591	0.58
155.0572357	0.16
156.2085876	0.11
161.0987549	9.14
163.0666504	1.57
169.1809998	0.26
171.2315674	0.13
175.0189209	5.02
179.0257568	1.74
185.0807495	0.73
187.0464478	1.59
198.8582001	0.21
203.0465088	0.36
217.1494598	4.07
251.2209015	0.58
263.0101929	0.73
279.1704102	1.74
291.1897278	6.79
295.1849365	1.91
311.2477417	36.69
321.4077454	0.42
323.2547913	100.00
330.1192322	0.52
341.1848755	20.37
351.2798462	0.31
359.0755920	0.57
367.1062317	0.54
383.5555115	0.53
428.3724060	0.19
431.5478821	0.33
441.3657532	0.25
456.0282898	0.13
467.2005310	2.22
468.4971313	0.33
483.9503784	1.48
485.2498169	7.85
494.3969421	0.76
495.6039429	1.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	205.0966
Annotation	Tryptophan
Peak:m/z	Relative Intensity
97.12174988	0.01
99.08868408	0.04
108.036911	0.06
113.9668274	0.02
114.9026642	0.01
126.088562	0.04
132.0700531	0.11
139.0236969	0.03
145.0238495	0.07
159.1830444	0.10
162.984726	0.04
168.1473083	0.02
169.1021271	0.15
185.96875	0.01
188.0678101	100.00
206.9890747	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2419
Annotation	Moniliforminol A
Peak:m/z	Relative Intensity
90.90736389	0.68
96.86707306	0.35
105.0644836	0.96
108.9636002	1.21
111.1260452	0.33
113.0050049	0.67
115.0658798	0.36
119.0794601	0.39
123.2359772	2.30
124.8628159	1.18
127.0071564	0.60
131.0262299	0.50
133.0785828	1.94
138.9456177	1.90
141.1676331	0.93
145.0175476	0.87
150.9427032	1.71
152.9458008	1.01
154.872879	0.20
157.1181335	0.20
159.0993652	1.00
169.1412811	1.23
171.1306152	0.25
172.7984009	0.41
175.4003601	0.38
176.9946747	2.46
181.2873688	0.83
183.0794067	2.01
185.0575562	2.20
189.3225403	0.59
193.2783813	1.40
195.2410126	1.99
196.9742889	7.09
199.115387	0.48
201.1394653	1.03
203.5090942	1.00
209.0753479	0.69
211.2813721	3.27
217.0898743	0.25
218.9504395	0.56
221.1737366	3.78
223.4397888	0.75
225.1174011	2.87
227.1907654	1.96
229.0497437	0.78
233.32901	1.59
235.8347473	1.85
237.0076294	0.79
239.2424927	6.12
243.299469	1.35
251.1875	4.63
253.1176147	1.57
255.3202209	1.95
255.9953003	0.76
261.2130127	4.46
269.2494507	1.77
279.2367554	100.00
279.9211426	0.24
288.280365	5.96
299.0265808	0.80
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	494.81
Annotation	Unknow
Peak:m/z	Relative Intensity
187.2230072	1.07
258.8640442	0.66
270.3018494	1.36
274.7666321	13.16
290.9193115	0.40
342.7573547	18.71
358.7731934	24.81
410.7879028	100.00
426.7820740	28.73
471.4056702	0.36
494.8064880	0.90
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	474.2166
Annotation	Unknow
Peak:m/z	Relative Intensity
144.9999390	1.99
162.8962250	2.25
180.9002533	0.62
213.1322784	0.51
253.1008301	1.09
258.9050293	4.54
270.9439392	2.41
275.8031616	0.43
277.0743713	1.95
288.9918823	14.72
293.7414551	29.70
294.3466797	12.64
306.9292908	3.50
311.8186035	100.00
312.5210266	0.81
324.9691162	27.10
342.1159668	1.89
343.0596313	6.64
357.4916992	0.37
374.6419373	0.86
413.1249390	0.68
427.9469299	1.20
456.3852844	0.86
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	332.1331
Annotation	5'-O-beta-D-Glucosylpyridoxine
Peak:m/z	Relative Intensity
106.0201340	0.12
107.9758911	1.44
115.8779144	0.05
124.0287857	0.07
134.0754242	0.26
135.9571228	1.59
151.9733276	4.67
154.0245514	0.10
155.1235046	0.03
160.2154541	0.03
164.1640015	0.01
170.1118774	7.48
171.2868652	0.04
189.8495331	0.02
194.0570526	0.11
199.1867371	0.12
202.9715881	0.03
211.1269836	0.01
211.9487915	0.02
213.3750000	0.09
217.0518188	0.12
221.8266907	0.05
229.7218628	0.03
230.6997070	0.10
231.3099976	0.03
232.0108643	0.07
236.0938110	0.03
242.1847534	0.02
245.1230469	0.09
253.9429016	0.03
259.1729431	0.12
260.2468567	0.02
278.2747498	0.10
286.1843262	0.04
290.6110840	0.01
295.9708862	0.21
296.6923218	0.04
314.1975708	100.00
326.9945068	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	714.7452
Annotation	Unknow
Peak:m/z	Relative Intensity
232.2123871	0.81
275.0176086	2.07
291.0136719	0.64
316.9924316	1.45
342.6856689	0.86
350.2420654	0.48
410.8540039	14.33
416.1543579	1.82
426.6708984	4.79
428.7864380	0.52
443.0959473	0.60
471.1804199	1.59
478.7308350	22.53
493.0332642	1.82
494.8084717	33.02
510.5087891	4.90
517.6939087	0.89
539.6638184	1.78
546.7274780	7.73
552.2531128	0.33
562.7346191	95.69
577.9449463	7.45
578.6593628	35.54
579.2857056	0.57
583.8164062	1.36
628.1341553	1.32
630.6651001	100.00
632.6694946	1.22
646.5767822	22.41
667.9260864	8.42
691.6231079	1.37
693.9728394	1.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	274.87
Annotation	gamma-Pentachlorocyclohexene
Peak:m/z	Relative Intensity
122.7912064	24.02
190.8282166	100.00
206.9167786	65.67
229.0786743	0.10
229.6866150	0.34
257.3081055	0.42
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	522.2816
Annotation	PS(18:2(9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
201.9894867	1.34
206.9515839	0.17
217.2158356	0.15
260.2838135	0.29
262.7650146	0.29
287.1920166	0.34
337.3196411	100.00
337.9954224	0.63
349.3603516	0.48
350.5959473	0.17
355.2940674	0.15
378.5479126	0.65
417.7122803	0.33
445.9283447	0.37
462.4342651	0.49
504.3797607	15.94
505.7467041	0.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	565.2289
Annotation	16-Hydroxymilolide M
Peak:m/z	Relative Intensity
158.7408600	0.06
176.0780945	0.03
178.9190826	0.24
197.1183624	0.08
202.1143951	0.04
205.1727600	0.05
247.0852203	0.02
269.1192017	0.08
271.2761536	0.02
280.2535400	0.02
315.6166382	0.03
323.3181152	0.24
325.3355103	0.66
328.4312744	0.07
330.1908569	0.42
338.1589355	0.15
339.4800415	0.24
342.5026855	0.04
343.5107422	0.15
359.5423584	0.21
360.3077393	0.48
361.4388428	1.90
373.6394043	0.02
382.4611206	0.03
393.0755005	0.09
401.2196655	0.06
417.0186157	0.07
421.0872192	0.04
431.2752075	0.13
434.4063721	0.07
441.7146606	0.14
449.1782837	0.06
467.1221313	0.17
468.2852783	0.07
469.2718506	0.08
474.4788818	0.26
475.3308716	0.31
476.0850830	0.17
477.8387451	0.06
479.0527344	0.20
491.6271362	0.03
498.3221436	0.14
505.4119263	100.00
513.6746216	0.11
518.5969849	0.72
519.5429077	1.59
520.7053223	0.20
521.5422363	0.15
523.3488159	12.88
524.0111694	0.06
528.1256104	0.09
532.8944702	0.05
535.5585327	0.06
542.9808350	0.02
543.7962646	0.35
545.5552979	0.04
547.2926025	0.51
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	588.0596
Annotation	Unknow
Peak:m/z	Relative Intensity
168.2359772	0.66
216.0002136	2.03
216.8820496	1.87
246.1107635	2.11
275.1865234	0.83
277.0491333	4.15
288.8479614	1.03
307.0610962	12.21
319.2796631	1.96
325.1176147	1.45
327.0547485	0.85
336.9505005	8.69
346.9881592	1.08
361.2452393	1.06
366.1157227	0.38
367.0642090	19.93
372.0598755	1.02
373.1591187	1.91
381.9878540	0.67
382.8535156	1.43
391.1336670	4.97
396.3851929	3.65
397.1827393	12.56
409.1706543	65.15
415.1043091	0.75
425.5010376	1.54
427.1763916	100.00
544.2258911	13.22
545.3800659	1.16
550.8502197	1.14
571.1821289	8.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	353.0876
Annotation	ST077074
Peak:m/z	Relative Intensity
109.1168365	0.04
111.1546478	0.06
114.9013519	0.02
127.1378937	0.13
135.1448364	0.64
136.7997742	0.05
143.1181488	0.03
155.0831299	0.06
161.0691833	0.43
171.166687	0.02
173.074707	0.59
179.063385	3.84
191.0266724	100.00
191.8369141	0.01
216.3005371	0.02
221.1565247	0.10
233.1416016	0.16
250.2623291	0.06
251.2556152	0.02
255.2918091	0.02
263.150116	0.02
267.2452393	0.02
281.3726501	0.03
290.1600037	0.15
307.0512695	0.22
309.3924561	0.04
323.0426331	0.02
335.081604	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	262.057
Annotation	Ascorbalamic acid
Peak:m/z	Relative Intensity
94.0131378	0.25
96.0012665	16.02
98.0112000	0.12
101.0305328	0.11
113.9607849	0.14
115.9868317	0.20
125.9963074	1.10
128.0175171	8.44
129.0475159	1.40
135.0225677	0.71
138.0785522	3.58
140.0248718	0.69
141.9786377	45.37
147.0723419	0.56
155.9270782	2.34
158.0597534	76.06
164.2480621	0.12
170.0054474	0.13
171.9136353	6.21
174.2393494	0.89
182.2012634	0.17
183.1317749	1.05
188.1302643	1.50
191.1464081	0.23
200.0013885	10.86
201.0792694	2.66
201.9893951	100.00
214.3012085	1.05
218.0333252	23.49
219.1107330	3.94
226.0326538	0.20
231.9916229	0.46
243.0184174	0.25
244.1093140	4.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	357.2031
Annotation	bicyclo-PGE2
Peak:m/z	Relative Intensity
103.0302353	0.08
122.9712677	1.13
136.6066589	0.24
140.8637390	0.28
145.8859558	0.09
170.1465759	0.10
173.0893097	0.06
174.9542542	0.22
181.1331940	0.09
185.2024384	0.47
187.0169373	0.43
194.9919891	0.26
196.8681030	0.48
199.2777557	0.15
201.0978699	0.08
219.0007629	0.15
223.1576233	0.23
234.8124390	0.24
245.6007385	0.35
247.1857605	0.08
257.1378784	100.00
263.2936401	0.13
267.1863403	0.21
269.2980652	0.18
271.8037109	0.14
273.1425171	0.28
274.0390930	0.38
274.7628479	0.21
281.1114197	0.20
285.0842896	0.48
286.1140747	0.34
287.2559204	0.27
297.3720703	2.09
298.0181885	0.65
311.2349243	0.08
315.0388184	0.49
333.3571777	0.13
338.3652039	0.18
339.3523560	4.25
340.1789551	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	463.2184
Annotation	Linalool 3,7-oxide beta-primeveroside
Peak:m/z	Relative Intensity
126.6788101	0.04
141.3360748	0.09
143.0565186	0.87
148.8082581	0.65
159.0438690	1.99
161.0911865	20.94
191.0137939	0.79
215.1632690	0.66
233.0898743	2.04
239.0722504	0.08
257.5129395	0.09
269.3566284	0.08
274.6347961	0.06
275.2915039	0.23
293.2153320	2.01
295.2862244	0.09
301.2317200	0.27
311.1260681	0.14
313.4375000	0.07
321.5799561	0.07
331.2551270	100.00
371.2017517	0.19
373.3945007	0.67
375.3448486	0.06
377.0613708	0.06
385.3023682	0.07
417.3995056	0.15
418.1912842	0.13
421.3250427	0.37
427.4259338	0.21
445.1532288	0.35
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	343.1377
Annotation	Semperoside
Peak:m/z	Relative Intensity
106.9651794	1.20
115.0438614	1.45
117.0747681	0.84
124.1696396	0.53
125.1211929	0.25
126.9004669	0.16
133.0774231	0.23
135.1058044	16.28
145.1514587	1.04
153.2185364	0.18
162.9512329	50.51
165.1149292	0.54
180.9581451	15.04
194.9205322	0.34
198.5968018	0.75
201.1250000	0.34
210.7762451	0.12
211.9303284	0.22
225.9921265	0.64
229.3455505	1.18
230.1451416	0.67
239.0633545	0.30
253.0249939	2.20
255.2246704	0.20
265.1604919	0.36
279.2710876	0.20
283.2630005	0.16
297.2377319	0.44
307.2587891	7.75
310.8392334	0.43
313.0513306	0.18
325.2279053	100.00
334.0417175	1.82
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	365.1049
Annotation	Lactulose
Peak:m/z	Relative Intensity
115.9643860	0.62
150.9559326	0.50
151.8638153	1.05
185.0102844	54.85
203.0818329	100.00
243.3566589	0.36
278.1136169	0.50
289.1420898	0.38
304.2371216	0.15
309.1080627	0.31
323.4838867	0.15
335.1160583	0.73
346.4639282	2.35
347.3056335	0.59
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	583.2028
Annotation	Sylvestroside IV
Peak:m/z	Relative Intensity
165.1692505	0.93
179.1442871	2.37
180.1911011	0.40
195.1195374	7.29
196.1556549	0.14
326.8289185	0.27
327.4297485	3.03
328.4447021	0.60
345.0722656	0.10
361.4513550	0.05
371.5206909	0.24
373.1132202	0.07
375.1066895	88.01
376.1889038	9.45
399.3599243	0.09
417.2516479	0.13
420.0385132	0.07
421.2784424	0.12
435.5036011	0.21
459.2111206	1.69
460.1832886	0.14
463.4320068	0.43
487.5167236	0.11
494.1736450	0.10
496.2941284	0.17
497.4230347	0.39
507.3687134	0.13
534.5516968	0.09
536.8952026	100.00
537.9241943	9.43
539.4834595	0.94
540.3639526	0.45
565.4791260	0.59
566.3705444	0.53
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	617.9
Annotation	Unknow
Peak:m/z	Relative Intensity
199.9624329	0.03
201.0839539	0.04
218.8091888	0.03
229.1260071	0.07
231.2145691	0.09
236.1723022	0.09
272.9619751	5.63
274.0937500	2.47
275.0408936	2.79
276.0260010	0.47
387.0201416	8.46
388.2106323	8.39
389.0497437	13.35
390.0189209	2.93
427.1248169	0.01
500.9891968	19.07
502.0188599	21.31
502.9856567	100.00
503.9513550	36.11
505.1976929	0.02
515.0851440	0.02
534.2677612	0.02
545.0288086	0.08
558.2994995	0.09
561.4981079	0.13
569.2705688	0.03
571.1030273	0.35
572.0100098	0.13
572.9036255	0.51
573.9017944	0.07
574.7163696	0.07
584.6224976	0.07
585.6190796	0.08
586.3232422	0.04
589.6243286	0.05
592.0816040	0.06
599.8300171	0.12
629.0056763	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	355.1013
Annotation	Scopolin
Peak:m/z	Relative Intensity
106.7537537	0.02
116.8429794	0.62
129.0532074	0.04
134.8354187	0.68
145.0216217	2.74
146.8902893	0.07
152.9803467	0.03
162.9795532	100.00
163.9461975	0.04
168.1704407	0.03
179.9932861	0.05
181.0875244	0.03
193.0504456	2.04
215.1924133	0.06
228.1259460	0.05
241.3420410	0.04
267.1555481	0.04
269.9324341	0.04
289.1596680	0.09
295.3074341	0.07
308.9641113	0.02
314.1360474	0.02
319.3051147	0.02
326.5831909	0.07
335.3900757	0.02
336.6804810	0.26
337.3502502	0.49
355.5831604	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2419
Annotation	Moniliforminol A
Peak:m/z	Relative Intensity
84.81780243	0.20
95.03843689	2.43
97.04524994	1.46
99.00822449	0.46
109.1195221	1.79
111.2146683	0.33
120.9662704	0.58
123.107254	1.23
128.987854	1.72
133.4123688	0.19
135.3354492	0.70
137.1454926	0.54
139.0240479	1.41
141.0189209	0.72
143.2181702	0.23
145.0854034	0.45
146.985321	2.11
151.1315918	0.30
153.0745544	2.81
155.072052	1.24
157.2497711	0.43
163.1248627	1.20
165.1050873	2.28
166.7288513	0.43
169.21521	1.20
171.0041656	1.30
175.1792908	1.19
177.0882263	0.32
177.808075	0.75
179.3726196	0.77
181.3013916	0.36
182.9479065	1.88
187.0666504	0.34
189.6109619	0.43
193.0187683	0.73
195.2992249	0.65
197.0904083	7.07
203.1576233	3.02
205.4560547	0.31
207.2358398	0.51
209.400177	0.51
211.2070312	2.77
215.0916748	0.72
219.3104858	0.40
221.2418823	5.83
223.2019958	0.87
225.1756287	2.22
227.1393433	0.97
233.2788696	2.75
237.2473755	3.77
239.2635803	12.56
242.4336243	0.58
243.2547302	3.79
251.2123108	7.95
253.2702942	1.20
255.3181763	1.69
256.9612427	0.21
261.3465576	3.24
269.0365295	2.71
279.2247009	100.00
279.8502197	0.45
280.6122131	0.64
282.6635742	2.26
288.2919922	2.94
297.1209717	0.42
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	532.79
Annotation	Unknow
Peak:m/z	Relative Intensity
197.0124817	1.10
280.9109497	15.66
286.9979553	0.36
296.7830811	2.20
321.3095093	0.09
328.9259644	0.13
332.6350098	0.06
351.1000977	0.24
364.6788940	63.59
365.3421021	0.50
370.8110962	0.32
380.6840820	8.94
401.4060059	0.16
413.1091919	0.08
427.1243896	0.06
442.7683716	0.17
446.7353516	0.95
448.0163574	9.36
448.6440430	100.00
449.4204102	0.08
460.9735107	1.09
464.3629761	0.76
465.0878906	0.05
468.7075806	0.22
472.7236938	0.91
486.6530762	0.29
515.2692261	0.57
515.9381714	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	260.1128
Annotation	Fumarycarnitine
Peak:m/z	Relative Intensity
107.8527679	0.33
111.9403229	0.68
133.9586639	0.38
161.1875153	0.68
172.2958984	1.04
174.5344391	0.52
190.0676117	1.43
198.9750671	1.14
219.0346375	1.31
232.4287720	1.18
237.0611115	1.12
242.1140900	9.59
242.8947144	0.78
251.1840363	100.00
270.0981445	0.86
378.2358704	1.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	361.1503
Annotation	5-Deoxylamiol
Peak:m/z	Relative Intensity
129.1438446	0.01
135.1335754	0.10
136.1480713	0.02
137.0699615	0.38
138.1480255	0.04
155.1321106	28.20
156.1707001	2.84
175.1313629	0.01
180.1205902	0.01
181.1478424	0.29
182.356842	0.01
195.9844971	0.01
199.0954285	100.00
200.1217957	9.39
288.3204956	0.01
300.1396484	0.02
302.1365356	0.01
315.2991333	0.06
316.0431213	0.01
317.1026917	0.01
318.8862305	0.04
324.1594543	0.03
326.1143799	0.02
329.2789307	0.04
342.0354004	0.01
343.2306824	2.30
344.3442993	0.35
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	263.09
Annotation	Ng-L-Glutamyl-L-aspartic acid
Peak:m/z	Relative Intensity
122.7806549	0.16
129.9416504	0.56
134.1853638	1.07
137.3746185	0.11
147.0548859	4.11
185.1844025	0.29
187.2181702	0.13
190.0918121	0.23
197.1672821	0.32
198.7701569	0.12
200.1336060	1.24
200.8280640	0.29
204.9605865	0.15
206.2012787	0.33
209.9416199	0.95
216.8736115	4.67
217.8270721	0.56
221.9953156	0.15
227.2461700	22.62
227.9884949	67.89
232.9994659	0.26
234.9637909	1.73
245.0004272	100.00
245.9989166	52.78
246.6849976	0.12
254.0830536	0.67
262.4290466	0.93
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	538.1253
Annotation	Unknow
Peak:m/z	Relative Intensity
181.2030029	0.21
198.9748993	0.21
201.2418213	0.12
210.9593964	0.07
230.9868469	3.66
234.9172058	0.26
263.0407104	0.74
288.4723511	0.11
289.1590271	0.30
306.1225586	9.19
315.8604736	0.26
317.1397705	3.85
322.1934814	0.16
334.1514282	100.00
364.2995605	0.21
391.3206787	0.21
392.0675659	0.62
409.1914673	82.19
445.2852783	0.48
447.7611084	0.24
463.4585571	0.93
475.1597290	0.33
502.0750122	0.17
520.3693237	12.39
521.1832886	0.84
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
111.1166992	1.09
123.105545	0.68
126.9450684	0.67
128.60112	0.90
129.2207947	0.79
132.9906616	2.79
137.1722565	0.30
139.1655884	0.92
143.1705627	1.48
145.115387	0.46
149.1343384	0.67
149.9901733	0.63
151.0346069	0.46
152.9109344	1.33
154.9402466	1.90
159.1366272	0.35
165.1993408	0.41
169.1038818	0.48
176.9782867	3.35
180.9187012	4.20
183.2096252	4.59
186.9260101	1.05
189.0745544	0.34
193.3758392	0.33
195.4185486	0.28
197.072052	3.08
205.0734863	0.28
207.2886353	0.77
209.2984009	0.69
210.9783936	5.15
213.1356506	2.12
215.2174377	0.25
218.3459167	0.53
221.2939148	0.97
223.3034058	0.74
225.2194214	2.54
226.2781067	0.20
227.5228882	0.40
229.1618347	2.85
231.2111511	0.34
233.17276	0.44
235.3504944	1.95
237.1706848	1.85
239.2332458	3.44
240.7160339	0.44
247.3254395	1.63
249.3511658	3.03
251.2663574	1.46
252.4354248	0.33
253.2464905	9.48
254.3244019	0.58
257.3226929	0.40
262.8813782	1.68
267.226532	1.62
268.2250977	0.81
269.3300781	1.36
270.3700256	0.30
275.3306885	22.11
279.1052856	0.41
283.3400879	3.02
290.9000549	1.00
293.2069702	100.00
294.100769	1.39
305.7794189	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	383.14
Annotation	16-iodo-hexadecanoic acid
Peak:m/z	Relative Intensity
130.0233154	0.58
145.0951843	0.40
156.0380554	0.27
171.8249664	1.66
174.1307678	0.19
175.1896362	1.15
190.0777740	0.33
201.8032227	0.35
203.0678101	14.91
215.3188477	0.49
217.1762085	8.93
220.0664368	1.70
221.0589600	8.45
227.2314758	2.82
231.2179260	0.27
245.1566162	3.50
251.2013245	0.28
252.3526917	0.82
263.1478577	68.11
269.3147888	0.79
281.3293152	0.23
282.8871155	0.67
284.5750732	0.14
287.2060242	1.69
291.9791260	0.37
293.0108643	1.55
299.3810425	0.72
322.4457703	0.14
323.1706848	0.31
329.1690674	5.45
347.1798706	14.25
348.3623657	6.76
351.0529480	0.30
354.2745056	0.21
365.2978821	100.00
366.5007019	0.45
386.8004150	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	391.2832
Annotation	Di(ethylhexyl) phthalate
Peak:m/z	Relative Intensity
121.0430679	8.52
139.3817749	7.81
149.0218811	100.00
150.0272522	17.18
166.9823608	38.90
205.3900604	14.17
213.2053833	4.61
215.2052307	7.54
219.4307098	3.64
258.9207458	6.58
259.8004456	7.04
261.6419373	16.32
279.0856323	18.02
280.3618164	35.46
290.3029785	8.56
334.0799866	8.05
342.4923706	36.03
343.1103516	21.42
351.0425415	14.20
356.7798157	8.79
361.4599915	11.96
374.1481628	11.13
375.1211853	20.83
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
76.89266205	0.50
102.9111633	1.56
104.9363403	0.77
109.1114197	1.89
113.0944061	0.93
128.9850922	10.03
140.8116608	0.56
143.0413666	0.98
151.0336914	100.00
151.9630585	8.84
153.1876984	0.56
154.106781	0.27
157.210144	0.48
165.1383514	0.87
166.6189117	1.81
167.2624359	1.53
169.0225983	1.90
172.1691284	1.55
175.3096771	0.75
178.1358032	1.82
179.1570587	1.92
180.0133667	1.16
181.9210663	1.17
183.2058258	1.27
185.1584015	2.55
197.1154633	4.82
198.2067413	0.47
208.1664276	0.66
225.1499023	9.49
235.1434479	3.43
238.1663666	10.49
239.2259064	3.29
251.1322174	1.06
253.0935822	54.50
254.0348053	1.56
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	353.0875
Annotation	Scopolin
Peak:m/z	Relative Intensity
102.1699677	0.01
111.0674438	0.01
123.1751862	0.01
126.9917603	0.08
135.0864868	0.70
143.2061768	0.04
144.9329224	0.01
155.0741272	0.05
161.1176147	0.40
171.2163696	0.01
172.9744415	0.34
177.0752716	0.01
179.0880127	3.95
181.0183105	0.01
189.2808990	0.02
191.0213623	100.00
191.8934937	0.04
216.1618958	0.01
217.2098694	0.01
233.1658630	0.07
239.3231201	0.01
242.1222229	0.02
250.3355713	0.03
251.2489929	0.02
257.0540161	0.02
263.1497803	0.03
265.1539001	0.02
291.2883301	0.02
293.2571716	0.01
305.3612061	0.01
306.4447632	0.01
307.2445068	0.02
309.2806396	0.14
310.1127625	0.02
315.3417358	0.01
323.6522827	0.02
325.4098511	0.01
332.2877808	0.03
334.3529053	0.01
335.7122498	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1027.35
Annotation	Unknow
Peak:m/z	Relative Intensity
598.5568848	0.17
654.0316162	0.09
720.9371338	0.29
938.1083984	0.13
1026.9744870	3.60
1027.8753660	1.70
1301.1210940	0.09
1521.2186280	0.35
1535.9960940	0.06
1559.9215090	0.15
1613.0068360	0.05
1638.9488530	0.06
1646.4359130	0.07
1652.2098390	1.52
1670.2674560	0.12
1678.3560790	0.14
1680.4776610	0.14
1687.7847900	0.17
1699.5983890	0.05
1703.6922610	0.10
1704.7454830	0.24
1715.0535890	0.35
1719.1857910	0.10
1721.5582280	0.58
1722.2613530	0.06
1725.9934080	2.46
1733.1771240	0.27
1739.3693850	0.09
1742.4095460	0.08
1747.3345950	0.09
1756.1954350	0.11
1769.1175540	0.09
1781.5975340	0.66
1783.6418460	0.14
1786.0393070	0.11
1788.1481930	0.24
1789.0289310	0.09
1790.2015380	0.84
1792.1268310	0.10
1794.0626220	0.48
1794.8780520	0.07
1797.9073490	0.11
1802.9201660	0.13
1804.4803470	0.24
1807.7327880	0.19
1809.2337650	0.13
1810.4390870	0.27
1813.4832760	0.10
1815.9727780	0.60
1817.3068850	0.18
1818.7136230	0.24
1820.3426510	0.37
1824.1527100	0.07
1827.0474850	0.18
1833.9294430	0.33
1835.1369630	0.22
1836.7581790	0.19
1838.1984860	0.50
1838.9154050	8.23
1843.6809080	0.10
1846.0183110	0.99
1847.3024900	1.68
1849.4388430	1.76
1850.9255370	0.74
1852.7930910	0.90
1854.0189210	0.17
1856.1774900	0.41
1857.3028560	0.76
1858.3933110	8.12
1859.8519290	0.56
1860.7088620	0.09
1861.9674070	0.07
1862.7103270	0.05
1864.0272220	0.56
1865.2927250	0.22
1866.3947750	0.18
1867.7491460	0.24
1872.0793460	0.06
1873.0920410	15.78
1874.1993410	0.34
1875.1574710	0.11
1876.4893800	0.62
1877.1898190	0.06
1879.4400630	0.80
1880.1090090	0.16
1881.2108150	0.27
1883.0911870	0.07
1884.6695560	0.26
1886.4333500	0.11
1888.3175050	1.52
1889.4230960	0.31
1891.4265140	0.42
1892.0451660	0.10
1893.1522220	1.09
1893.8815920	4.18
1895.2888180	0.15
1896.2054440	0.21
1897.4393310	0.12
1898.0650630	0.07
1901.2593990	0.75
1902.4943850	0.41
1903.2933350	0.07
1904.6732180	0.14
1905.9144290	0.19
1906.9439700	0.80
1908.4466550	0.14
1909.3463130	0.24
1910.5339360	0.27
1911.6173100	0.34
1912.7757570	0.18
1915.1026610	0.63
1915.9930420	0.05
1917.4510500	0.10
1918.7117920	0.32
1919.9567870	0.16
1920.7652590	0.09
1922.0157470	23.94
1922.6511230	0.11
1923.8460690	5.64
1924.6492920	0.39
1925.6706540	0.55
1926.9364010	1.84
1927.8634030	0.06
1928.6285400	0.09
1930.1940920	0.28
1931.4744870	0.21
1932.5178220	1.30
1933.5485840	0.08
1935.0189210	0.41
1935.7506100	0.09
1936.6564940	0.39
1937.4998780	0.10
1938.2355960	0.30
1938.8697510	10.04
1939.7644040	1.80
1940.6993410	0.93
1941.7513430	1.29
1942.4729000	0.10
1943.9461670	0.20
1945.0482180	1.73
1945.8396000	0.66
1947.3225100	1.30
1948.1569820	0.14
1950.3732910	1.91
1951.2418210	0.44
1952.1478270	4.94
1953.4016110	2.45
1954.5733640	0.96
1955.8004150	0.67
1956.4411620	0.48
1957.7579350	1.93
1959.1060790	2.34
1960.0352780	20.93
1960.8820800	0.13
1961.9567870	1.59
1963.3018800	0.24
1964.2873540	1.19
1965.5026860	1.36
1966.2318120	1.55
1966.9361570	0.55
1967.8013920	0.10
1969.5588380	3.83
1970.3937990	2.45
1971.3000490	0.64
1973.0158690	2.00
1974.0603030	0.09
1976.1184080	0.17
1977.6343990	2.82
1978.6915280	2.33
1979.5533450	7.30
1980.4630130	1.66
1981.4440920	0.15
1982.9934080	12.42
1983.8547360	0.49
1985.2603760	4.93
1986.4605710	0.06
1987.5975340	0.99
1988.2884520	34.97
1989.4113770	12.11
1990.6517330	100.00
1991.8062740	1.45
1992.7606200	0.99
1993.4250490	0.13
1994.5271000	8.48
1995.3319090	4.82
1996.3072510	0.13
1997.2989500	5.15
1998.0113530	23.21
1998.8718260	1.79
1999.9025880	1.42
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	260.1127
Annotation	Fumarycarnitine
Peak:m/z	Relative Intensity
97.0384521	0.35
137.4174805	0.63
138.1365204	0.50
155.8099213	0.58
157.0094147	0.34
161.1409149	0.38
165.1515350	0.53
168.3595734	0.31
172.4852753	0.23
182.1762848	0.20
185.1545410	0.39
188.0998993	0.20
196.9826202	0.56
203.3147278	0.38
204.4637604	0.23
214.3323212	0.65
215.9376984	0.20
219.0959930	1.38
225.1229401	0.82
229.0915070	0.68
229.7601166	0.20
232.1718292	0.64
233.0625763	0.24
237.1358795	0.72
242.1566925	13.76
243.0598907	1.38
251.0640869	100.00
268.1877441	0.42
299.1182861	0.26
366.9310608	0.13
378.5949707	0.36
397.4089661	0.50
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	205.0966
Annotation	Tryptophan
Peak:m/z	Relative Intensity
84.02125549	0.03
84.93391418	0.03
108.9761963	0.07
113.9314423	0.04
114.8047943	0.02
118.0252838	0.02
125.9600067	0.08
127.200882	0.02
132.1487732	0.11
135.1188354	0.01
138.8974457	0.14
141.7462463	0.14
143.9042511	0.05
145.061264	0.25
157.0551147	0.04
159.0304718	0.06
161.1511078	0.03
161.9853973	0.04
162.8956146	0.07
169.0314178	0.70
176.9697723	0.20
188.0974884	100.00
189.9629974	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	259.0919
Annotation	Ribothymidine
Peak:m/z	Relative Intensity
83.9563675	0.73
104.9246521	0.08
110.9868317	0.10
116.1083984	0.08
130.0420990	100.00
130.8357086	0.06
145.8724365	0.26
159.0005341	0.11
171.2249298	0.15
177.8633270	0.32
179.2944183	0.15
184.9290314	0.11
193.9345398	0.15
201.2311249	0.09
213.2068787	0.41
216.8281097	0.05
222.8304901	0.20
241.1659546	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1091
Annotation	Lactulose
Peak:m/z	Relative Intensity
89.0713196	0.12
101.0118408	6.48
102.9625397	0.14
106.4135895	0.59
113.0177002	17.38
114.9621964	0.71
119.0121384	16.34
125.0391464	2.52
130.8796539	8.12
138.8999634	0.07
142.9565125	18.60
148.9287262	3.15
161.0507660	22.63
179.0214539	100.00
183.9166565	0.07
190.7373962	0.09
209.0998230	0.31
215.2724304	0.15
220.9637146	1.54
257.2813721	0.06
279.0158691	0.06
280.9638062	2.52
295.2356873	1.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	299.0771
Annotation	Pseudolaroside A
Peak:m/z	Relative Intensity
92.86914825	4.95
120.728363	0.14
137.0225372	100.00
160.126358	0.14
173.2279358	0.10
176.8737793	0.34
184.0905914	0.26
199.3189087	0.12
201.2172241	0.14
203.0777588	0.72
209.0325012	0.10
212.879425	0.53
227.1927795	0.23
237.403717	0.14
239.2946472	0.30
241.0479431	0.38
252.1966248	0.22
253.1099548	5.88
255.0960693	0.55
259.0587158	0.35
269.2115479	0.28
271.1581421	0.24
279.0514526	0.18
281.1291809	2.22
284.0973511	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	311.169
Annotation	5S-HETE-d8
Peak:m/z	Relative Intensity
113.0968704	0.46
150.9041138	1.67
170.0966492	2.43
179.1438904	0.50
183.0072021	100.00
184.0690918	11.92
185.2327271	1.03
197.0874329	17.87
198.1120148	7.70
210.759552	2.75
212.0100403	1.37
223.4519958	1.04
225.1745911	2.19
226.184082	2.42
227.2948608	11.13
238.0533447	0.56
239.2526245	9.86
247.2715454	4.84
249.1822815	3.70
251.5321655	0.90
253.2058411	4.42
255.1738281	0.58
263.4143982	0.24
264.355835	0.99
265.8193054	1.48
267.2228394	9.96
274.9005737	0.71
275.5201721	0.46
291.4599609	1.17
293.2991943	28.81
294.2192078	0.23
295.0439453	1.05
311.471344	11.10
312.3370667	1.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	426.29
Annotation	Prostaglandin E2 serinol amide
Peak:m/z	Relative Intensity
138.888031	9.76
143.1000214	5.81
156.6517944	8.88
167.1752625	13.53
168.9109802	15.20
181.1990051	13.98
188.2145691	10.07
191.3155975	9.58
197.4158936	20.76
253.238678	29.87
271.3640442	11.55
313.1074524	12.53
336.0288696	12.52
339.7108459	13.88
357.5767212	6.95
359.1974487	8.42
367.7189026	9.36
377.4039612	15.69
379.4213562	16.17
381.4988098	12.20
385.3152161	5.53
390.8322449	13.10
398.0623474	13.55
407.2432251	6.30
408.2658386	100.00
409.2774963	11.52
410.082489	25.94
426.3130188	14.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	509.2238
Annotation	Linalool 3,7-oxide beta-primeveroside
Peak:m/z	Relative Intensity
184.9899139	0.06
275.3006592	0.13
305.2108154	0.07
314.1358643	0.14
329.3474121	0.14
330.3771362	0.05
332.1582642	0.09
339.0038452	0.13
347.2974243	0.99
348.1826172	0.28
352.6656494	0.05
363.9423218	0.05
376.2774048	0.28
379.1702881	0.05
414.2213745	0.31
420.4719849	0.03
423.4038086	0.14
463.3297119	100.00
464.4168091	41.85
465.6885986	0.13
474.2167358	0.17
479.2701416	0.21
480.4708862	0.27
488.4246216	0.33
490.7282715	0.06
491.4010620	0.19
492.3580933	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1189.87
Annotation	Unknow
Peak:m/z	Relative Intensity
563.3007202	0.30
777.8150024	0.62
871.2731934	1.10
879.6069336	1.71
959.5277100	2.85
961.7869873	1.03
1000.5766600	1.25
1015.3933110	1.08
1036.7026370	1.03
1038.5014650	0.77
1072.6790770	0.31
1111.5476070	0.30
1129.1530760	1.85
1164.2716060	0.90
1190.6002200	0.28
1199.5083010	1.45
1205.3750000	2.67
1239.3083500	3.44
1255.7807620	4.54
1257.4357910	2.89
1266.7810060	9.89
1273.7199710	3.58
1295.5844730	8.41
1298.2736820	6.01
1299.3948970	0.88
1303.6405030	3.34
1305.6055910	0.74
1306.8834230	0.94
1307.7618410	0.25
1312.6872560	2.50
1314.8598630	4.72
1364.0174560	1.88
1400.3576660	1.48
1415.8843990	5.91
1438.9978030	0.32
1443.6772460	2.64
1471.9157710	2.58
1485.9068600	0.39
1497.5541990	2.37
1510.3461910	0.33
1526.7625730	0.67
1541.7702640	1.70
1558.8131100	0.23
1615.5234380	0.40
1628.1129150	1.04
1677.7952880	0.87
1716.1007080	1.03
1729.7633060	0.28
1747.9508060	0.57
1758.4622800	0.36
1766.0091550	0.66
1769.5325930	0.48
1791.6148680	2.56
1795.6003420	0.54
1813.6326900	0.65
1818.1033940	1.93
1818.7301030	3.53
1824.3753660	0.49
1828.3909910	1.06
1839.9348140	0.61
1843.6906740	0.44
1850.6383060	2.91
1852.0612790	1.08
1856.7712400	0.20
1860.8094480	0.41
1863.3192140	0.65
1871.2882080	0.50
1873.4827880	1.64
1877.2518310	0.70
1878.5686040	2.94
1888.9932860	1.00
1891.6018070	8.45
1896.3824460	1.27
1898.1646730	9.57
1900.0905760	1.43
1905.9743650	1.17
1906.8438720	6.94
1909.2346190	23.57
1911.4354250	1.26
1912.3052980	2.76
1913.1800540	1.12
1913.7937010	0.25
1916.4918210	1.10
1918.2728270	6.39
1920.1412350	9.02
1922.3817140	4.09
1923.3182370	0.80
1924.5064700	2.05
1926.7159420	1.53
1927.7902830	4.34
1931.3211670	2.32
1933.8470460	2.09
1935.1662600	0.51
1937.6345210	0.98
1939.3214110	0.45
1942.2829590	15.49
1943.0614010	5.09
1945.6717530	52.01
1948.3302000	7.55
1949.9251710	0.68
1950.5832520	0.58
1952.4123540	1.35
1954.3292240	9.84
1956.6387940	0.23
1957.8953860	2.15
1959.1983640	15.76
1960.5589600	2.01
1961.3353270	1.06
1962.6540530	2.87
1963.6940920	22.53
1965.3562010	3.35
1966.5427250	8.58
1967.9229740	36.37
1968.7398680	0.28
1970.2873540	7.47
1971.3648680	85.31
1974.2808840	40.53
1975.8472900	4.65
1977.2752690	1.01
1977.9172360	1.47
1979.2673340	0.70
1980.0882570	0.41
1982.5520020	50.61
1983.4947510	28.20
1985.0015870	2.80
1987.8337400	0.46
1990.1566160	20.09
1991.5694580	11.25
1992.2664790	0.36
1993.6187740	0.72
1994.7121580	1.21
1996.6068120	44.41
1997.6348880	5.54
1998.7873540	0.93
1999.5491940	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	520.3386
Annotation	PC(18:2(2E,4E)/0:0)
Peak:m/z	Relative Intensity
165.9853668	0.63
184.0280762	100.00
233.1991882	0.34
258.0200806	0.81
265.5538330	0.09
303.8527832	0.13
385.5596313	0.15
390.2482910	0.15
407.4321899	0.09
443.2254639	0.17
474.4465942	0.13
502.5503540	82.54
503.6627197	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	259.0787
Annotation	4'-Hydroxyflurbiprofen
Peak:m/z	Relative Intensity
97.0009384	0.11
139.9507751	1.85
145.0105286	2.06
157.8799591	0.07
167.0329437	0.11
170.9249878	0.13
175.1879730	0.08
187.1538239	0.29
188.1386871	0.10
196.0946808	6.18
199.1000214	0.03
200.2742462	0.03
201.2230682	0.07
204.7077179	0.15
211.3286133	0.02
213.0985413	100.00
214.1404877	1.70
215.1174011	0.45
223.0105438	0.02
231.0863647	24.84
241.1393280	0.71
242.2513428	0.26
249.0062408	0.13
259.1068115	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	391.2834
Annotation	Di(ethylhexyl) phthalate
Peak:m/z	Relative Intensity
113.1868057	1.90
122.3443069	1.90
125.9740906	6.90
133.0886536	2.13
149.0263824	100.00
150.0101013	18.10
159.2461853	2.13
167.0101166	29.19
167.8986511	15.59
211.272049	2.70
228.8887634	2.09
230.1434021	10.55
233.6158752	8.47
235.3360291	1.21
254.2233887	7.96
258.0330811	3.22
260.6264038	14.78
261.3586121	32.41
262.2276917	3.15
268.28302	2.81
269.4181519	1.46
275.0584106	1.76
279.1524658	32.12
280.0918579	26.53
287.1769714	3.03
301.8549805	7.39
305.6802063	3.49
311.4046326	3.91
313.272644	2.47
319.9517212	3.73
329.2454529	3.52
329.9538879	2.65
334.3435364	9.17
338.8543091	1.86
347.072998	5.21
348.0032349	9.91
351.0051575	3.67
357.0067444	7.24
361.2489929	4.02
374.2258911	32.20
375.208374	9.42
382.802887	3.23
383.6810913	6.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	500.9202
Annotation	Unknow
Peak:m/z	Relative Intensity
158.9339142	3.45
159.9944000	0.33
199.1312561	0.25
199.9934998	0.11
217.9462585	0.19
229.0915527	0.80
230.0688019	0.06
272.9849854	59.09
273.9865112	18.33
372.1081543	0.04
385.0802917	0.09
386.9802856	100.00
387.9730835	52.88
388.5885620	0.10
428.0358582	0.04
455.2150879	0.09
457.1052551	0.30
475.0790100	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	258.9
Annotation	Unknow
Peak:m/z	Relative Intensity
122.8286285	97.16
174.8724823	2.03
184.4425812	0.24
190.9355621	100.00
240.3456421	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	524.1959
Annotation	Herbicidin E
Peak:m/z	Relative Intensity
146.9176788	1.94
165.0245361	15.59
166.2657318	0.35
167.0941162	0.12
182.0211334	100.00
223.4943390	0.58
271.1031494	0.29
306.8307495	0.24
318.1601562	0.30
324.1406250	1.75
325.2322388	0.37
327.3297729	0.38
328.0559692	0.28
332.0972900	0.16
343.3701782	0.66
344.2509155	1.70
361.9273682	1.94
375.3574829	0.64
377.2067261	0.64
389.8237915	0.60
393.1281128	0.34
395.0761719	0.28
431.2976685	0.62
449.3272705	0.91
463.4711304	0.43
499.3359985	0.40
506.2460327	1.41
515.0477905	0.85
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	611.1451
Annotation	Oxidized glutathione
Peak:m/z	Relative Intensity
171.1899414	0.04
176.9038696	0.34
179.1788177	1.84
179.9060669	0.03
182.2314911	0.04
185.1019440	0.48
192.0411835	0.10
193.0315247	0.02
197.0582886	0.46
203.0235901	0.10
208.1688232	0.08
209.1302032	0.12
210.1836548	3.89
211.1054993	0.15
213.0090637	0.09
221.4090271	0.04
228.4881287	0.03
231.2323608	0.03
236.1931305	0.11
242.0182800	0.18
252.0304871	0.12
254.1612244	15.06
260.0406494	0.03
263.1252747	0.25
267.9237061	0.84
269.1942139	0.22
272.2266235	38.77
286.1631470	0.92
287.1465454	0.02
288.2547607	4.07
299.0994263	0.05
304.1349487	15.21
306.1582031	100.00
310.0952759	0.04
313.1788330	0.09
320.1547852	0.50
338.1403809	41.81
353.2155762	0.62
361.3028564	0.13
362.1758423	0.09
399.6152344	0.06
431.4335938	0.07
452.2125244	0.12
464.2179565	1.24
482.2421875	31.26
483.3120117	0.03
490.3754272	0.09
520.9306030	0.07
536.1748657	0.21
547.3521118	0.08
568.4831543	0.09
575.2672729	0.73
593.2802734	17.10
594.3872681	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	409.0442
Annotation	Unknow
Peak:m/z	Relative Intensity
122.8878174	0.04
125.0425873	0.08
138.9655609	1.69
150.8142548	0.05
164.9175415	0.50
167.0550995	0.78
168.9865112	0.09
180.8367920	0.38
193.1162720	0.09
197.1918182	0.06
199.0343170	0.21
209.2048340	0.14
223.0231323	2.88
226.3005371	0.06
229.1446228	0.13
239.1065979	0.35
241.0480347	100.00
279.1998291	0.20
293.1367798	0.18
310.0981445	0.08
311.6181335	0.10
313.0996704	0.15
325.0560608	0.07
329.3277283	0.81
341.2086182	0.11
361.5581665	0.05
363.1927795	1.54
364.1482849	0.49
365.4389954	0.07
367.5532532	0.03
381.4049377	0.41
391.3159180	1.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	527.08
Annotation	Unknow
Peak:m/z	Relative Intensity
161.2459717	0.05
179.0745544	1.54
185.0298004	2.11
203.1020813	8.55
205.2642975	0.05
285.3032532	0.02
297.3198853	0.08
303.0526123	0.03
321.2341309	0.02
341.2313232	0.28
347.0781860	0.19
358.8458252	0.02
365.1345215	100.00
365.7745361	0.10
383.3682861	0.07
388.9938354	0.03
425.3887329	0.02
431.1413574	0.02
465.6107788	0.04
481.5256958	0.11
483.3123779	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	457.1199
Annotation	12-chloroisoplagiochin D
Peak:m/z	Relative Intensity
142.9254150	0.18
149.0166168	0.05
161.1612244	0.10
178.9865723	0.64
221.2175903	0.05
277.1596680	0.11
295.1980896	0.23
341.1997681	100.00
347.4368896	0.11
364.8927307	0.11
396.9946594	0.47
411.1235657	0.06
439.2990723	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	637.1769
Annotation	Cannabin
Peak:m/z	Relative Intensity
193.1131134	0.15
206.7941589	0.08
253.1716003	0.10
317.3050232	0.10
337.2888794	0.14
341.2092896	0.07
370.9042969	0.11
378.1997681	0.08
389.1329346	1.99
393.1569824	0.08
395.2171021	0.07
461.5285034	0.09
464.5161133	0.03
473.3936157	0.11
487.1665649	0.16
493.5055542	0.31
498.5089722	0.06
512.1547241	0.05
517.4146729	0.06
527.9207153	0.06
533.5484009	0.21
534.9801636	0.13
551.6232300	0.14
565.0855103	0.17
590.0940552	0.15
591.1345825	0.34
593.2233887	100.00
593.9692993	0.20
601.6798706	0.37
618.3867798	0.06
619.5344849	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2417
Annotation	Moniliforminol A
Peak:m/z	Relative Intensity
94.95711517	0.35
109.0891724	2.17
112.5514984	0.28
113.2198029	0.72
118.8766785	0.18
121.1792145	0.47
123.0672607	1.09
125.0518951	0.27
126.8781738	0.54
132.9746704	0.61
135.1670532	1.11
135.9880676	0.17
136.9846649	1.05
139.0492249	2.82
140.8074036	0.56
143.0660858	0.17
144.9325867	0.77
146.9503784	0.17
148.7967834	0.24
151.0601959	0.44
153.0195007	3.44
155.0656433	1.11
157.04776	0.45
159.1900024	0.63
161.0694885	0.95
163.1325684	0.42
164.9156189	0.50
165.520874	0.20
167.2102661	0.70
169.3735046	0.56
171.1624298	0.91
175.2881775	0.95
179.2255554	0.52
180.8610992	0.49
181.5336914	0.22
182.8589478	0.59
183.6013489	0.47
185.1142578	0.51
185.8160706	0.32
187.1921997	0.46
193.1904602	1.59
195.1074219	0.51
197.0789795	3.09
199.2634888	2.37
201.2123718	0.80
203.222229	1.02
205.0769043	0.17
206.7087097	0.72
207.8301086	0.25
211.3184204	3.32
213.1711731	1.88
215.4561462	1.60
217.4076538	0.25
218.4082947	0.68
219.1984253	1.45
221.1838074	0.77
223.1355286	2.03
225.1211243	0.36
227.3223267	2.63
229.0263672	0.25
231.2333069	0.48
233.2802734	2.99
235.2124023	0.48
236.4007874	0.18
237.3722839	4.85
239.3100586	15.53
241.2183228	0.54
243.270874	3.06
250.1641846	0.88
251.1244507	3.91
253.1338501	1.75
255.1160278	2.99
256.121521	0.76
257.0835876	0.83
259.0629272	0.70
260.418457	0.23
261.1799011	7.18
265.3301697	2.04
269.1991577	2.51
271.2341309	0.42
273.530365	0.63
279.2400513	100.00
280.0854492	1.18
282.324646	0.18
288.1044312	4.02
290.0404663	0.28
296.5388184	0.90
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	649.2307
Annotation	Unknow
Peak:m/z	Relative Intensity
233.0244751	0.12
262.2579651	0.06
281.1755371	0.27
288.1732788	0.07
323.2227783	1.62
327.3970947	0.05
341.0910034	0.52
503.2908325	100.00
509.3610840	0.15
513.5859985	0.14
560.1371460	0.11
613.4932861	0.13
631.1323242	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	246.0603
Annotation	Ascorbalamic acid
Peak:m/z	Relative Intensity
84.9693756	0.20
95.9623871	0.03
107.9651642	0.08
127.9852448	0.41
138.0396576	0.45
139.0349121	0.05
143.9861298	0.57
145.9195404	0.20
153.9656372	0.07
156.0248871	0.54
158.1644135	0.08
164.1269379	0.09
168.1483612	0.05
170.0605927	0.27
173.9563141	100.00
181.8686676	0.06
185.9145966	0.36
200.1505737	0.86
202.4136353	0.04
204.0768280	0.07
210.0449677	1.69
218.1822510	0.15
228.0039062	27.68
229.0996857	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	268.2057
Annotation	Pentazocine
Peak:m/z	Relative Intensity
93.0734863	0.92
94.0585175	0.52
95.0278320	0.13
97.2269211	0.04
105.8831482	1.96
106.9848938	1.75
108.1267242	0.59
112.9688263	0.11
117.0171661	0.71
118.0462799	1.15
120.1819305	0.41
120.8718414	0.14
125.2478790	0.05
127.8312988	0.09
130.0625458	4.85
131.0861664	1.74
132.1292114	0.86
133.0850677	0.07
134.1419830	0.09
135.0876617	0.05
141.0482330	0.59
142.1090546	1.38
142.9673615	0.85
144.0555420	2.17
145.0562897	0.71
146.1183777	0.58
150.9949951	0.13
151.7571716	0.08
152.9293976	0.72
153.9554291	0.27
155.0010529	1.11
156.1168671	2.45
157.0298309	2.37
158.0724030	2.63
159.1953278	0.15
160.1386261	0.50
160.9883881	0.50
162.0910339	0.94
165.1193237	0.45
166.4486084	1.44
167.1706085	2.89
168.1183319	4.70
169.0139923	3.97
170.0337372	6.34
171.1848907	0.82
172.1987762	0.20
174.0149384	0.23
175.2073212	0.11
176.1229706	2.14
179.0817719	0.23
180.0684052	0.69
182.0148926	100.00
183.0724487	15.70
184.1380615	13.34
185.1414490	0.53
188.3177948	0.15
190.2394867	0.39
192.9807739	0.47
194.0910797	1.24
195.3677216	3.30
196.1479340	48.74
197.0789490	36.10
198.2006989	12.25
199.2812500	0.44
200.0269012	0.62
202.0976410	1.33
203.2628784	0.16
207.1165619	0.07
208.3201599	0.17
209.1372070	0.73
210.1051178	14.74
211.1273956	5.89
212.2881622	1.95
213.1792297	0.65
214.2471771	7.27
215.1266022	0.48
221.1310272	0.09
224.2082672	4.34
225.3945007	1.31
226.2462006	1.21
238.1786346	7.34
239.1830902	0.74
240.2234650	5.66
242.0672150	0.09
249.3845825	0.15
250.2650146	0.44
251.4883270	0.70
252.2362823	2.60
253.0978546	1.84
253.8937531	0.33
266.2405396	6.50
267.2219238	0.20
268.3284607	8.34
269.4609985	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	507.157
Annotation	Unknow
Peak:m/z	Relative Intensity
147.0138855	0.36
164.9711761	100.00
171.2549896	0.08
297.1007690	0.68
311.4025269	0.15
325.4644775	0.06
327.5238342	0.11
340.5375977	0.17
341.2901306	0.40
342.1388550	0.20
395.4158630	0.36
463.6135559	0.05
488.2946472	0.37
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	493.2286
Annotation	L-Linalool 3-[xylosyl-(1->6)-glucoside]
Peak:m/z	Relative Intensity
177.2677002	0.04
232.9838104	0.03
278.3917847	0.09
289.1971436	0.10
305.1743469	0.03
306.4586487	0.06
335.4785461	0.05
342.3906250	0.03
349.3422241	2.76
350.3522034	0.25
363.0827332	0.07
365.4342957	0.06
373.9844971	0.07
391.4754639	1.12
392.5418091	0.15
398.2510681	0.12
405.1869202	0.04
409.7916565	0.07
421.8357239	0.05
430.6368713	0.03
431.4183044	0.51
433.3462524	0.05
436.1451111	0.08
447.3870850	100.00
448.3584290	42.36
449.1695862	0.01
450.7485657	0.19
456.4272461	0.14
457.4296875	0.02
458.2857666	0.14
464.0325623	0.08
476.0755005	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	837.0311
Annotation	Unknow
Peak:m/z	Relative Intensity
281.9906006	0.77
290.2537231	0.59
292.9397278	0.35
300.3067627	0.64
302.2782593	0.65
315.0968933	0.14
318.1323242	5.36
319.2970886	0.28
320.3377686	0.27
358.4895020	0.99
368.9714966	0.23
377.1324463	0.19
387.3167725	2.20
387.9749451	2.45
389.2623291	1.70
397.5061035	0.26
404.4422607	0.24
405.5318604	0.54
406.6342163	0.65
407.5522461	1.37
413.1452637	0.84
414.5917358	0.29
417.2526855	0.43
422.7080078	1.15
431.1422729	1.26
432.0800781	1.69
440.4989624	0.34
442.4003296	0.43
444.5250244	0.57
450.1486816	0.73
460.4445801	0.33
464.6091919	2.71
468.4026489	0.68
469.5852051	0.67
482.3456421	0.19
483.3477783	0.24
485.9315796	1.26
500.0619507	6.40
501.2145386	2.06
505.4700317	0.35
518.2035522	1.60
519.4254150	2.06
521.6118164	0.46
535.5622559	0.85
536.4631348	0.33
542.5000000	0.16
544.9082642	2.02
553.3660889	0.82
554.5666504	1.26
557.3248901	0.37
563.3524780	0.19
571.3687744	1.09
575.2359009	2.25
576.3355713	0.64
588.9714966	0.94
589.6904907	0.46
593.4534302	2.83
594.4682007	1.40
597.1433105	2.24
599.1459351	4.31
600.1616211	5.32
601.0807495	2.19
603.4984741	3.11
608.6358643	2.45
616.0463257	0.70
624.4771118	0.38
626.1093750	5.55
628.6492310	0.26
632.1962891	13.28
645.0707397	1.24
655.8854980	1.93
660.5659790	0.94
673.0459595	1.01
674.3743896	1.63
678.5849609	0.86
679.7256470	1.16
680.8637085	0.27
682.8600464	1.01
688.4112549	1.90
694.2969971	9.21
698.1099243	1.93
705.9451294	1.49
712.9606323	0.86
713.9275513	0.50
715.7634888	0.96
717.6100464	0.25
721.3950806	0.40
723.1644897	2.42
726.9831543	1.49
729.5714722	0.18
731.7189941	1.36
732.6227417	9.72
733.5055542	4.45
736.8238525	0.43
738.4644165	0.16
740.5920410	0.49
744.6607056	2.62
745.5216064	0.37
748.6724243	0.43
753.7846680	6.51
754.4824829	0.79
755.4135742	0.61
756.4169312	9.95
757.2550659	6.52
758.4261475	0.38
759.9178467	3.25
762.8666382	3.81
763.6082153	0.64
764.9491577	0.46
766.1660767	5.00
766.9542847	4.05
768.6782837	0.88
770.9308472	6.74
782.3877563	0.67
783.2979126	1.89
787.7929077	2.51
789.2734985	0.68
790.5286255	0.99
794.0414429	3.04
796.8381958	0.79
799.8967896	16.33
800.5515137	8.71
802.1983032	1.39
802.9326782	0.95
804.9351196	1.39
805.8991089	0.87
806.6018677	0.52
807.8232422	0.65
809.1585693	1.27
811.2363281	1.82
812.2379761	1.72
813.4017944	0.45
815.1063843	0.40
817.6567993	0.27
819.5067749	2.84
825.7158203	11.30
826.4760742	3.46
827.3113403	0.78
828.3004761	0.41
837.5122681	0.86
851.6421509	0.40
856.6222534	0.54
859.7108765	0.68
860.9896851	0.51
867.7448120	0.69
868.8242798	1.84
871.4817505	0.85
873.4064331	0.31
876.5429077	0.92
877.4905396	1.24
878.2072144	2.16
879.2402954	2.08
885.6885986	7.79
886.8392944	2.58
887.8541260	0.45
890.8482056	1.65
895.4243774	0.34
905.0233765	0.74
907.3378906	0.96
908.2062378	0.35
916.3769531	1.78
917.9044800	1.50
919.4761353	1.22
930.1677856	3.22
931.2184448	0.55
935.3984985	0.17
937.9507446	3.07
938.9255981	13.84
939.8356934	2.31
941.4323120	0.23
947.5190430	100.00
948.2988892	57.50
949.2498169	10.46
953.9098511	0.14
959.7727051	0.31
966.5449219	0.51
969.5612793	0.64
979.6261597	1.51
980.3723755	1.68
980.9767456	0.41
986.7158203	2.52
987.7145996	5.99
988.5319824	1.61
990.7144165	0.17
991.6560669	0.71
997.0356445	7.04
997.7783203	7.36
1006.1314090	0.65
1008.6840210	0.76
1022.7028200	0.71
1023.9765010	2.34
1024.7573240	1.43
1030.7094730	0.43
1032.0224610	3.02
1040.5273440	6.88
1041.3503420	3.63
1042.5549320	1.38
1043.5974120	0.36
1049.5904540	0.46
1052.6470950	0.30
1055.3062740	0.43
1057.6958010	0.94
1066.5566410	0.23
1067.3205570	0.85
1069.3920900	3.91
1070.6256100	0.16
1087.6411130	6.01
1088.7629390	9.34
1089.6788330	1.58
1090.3603520	0.98
1094.6667480	1.22
1098.2204590	5.43
1100.7285160	0.20
1102.1947020	0.34
1105.8726810	1.05
1109.9346920	0.77
1111.8991700	0.25
1119.9694820	0.24
1137.5139160	1.21
1138.8713380	0.49
1139.5224610	0.21
1147.5128170	0.35
1148.7845460	1.23
1149.3896480	0.48
1150.8424070	0.99
1155.6828610	4.73
1156.6281740	6.07
1157.8856200	0.28
1159.4704590	3.01
1166.0625000	1.14
1166.7742920	2.43
1167.8557130	0.35
1168.7965090	5.45
1169.5627440	0.66
1170.2236330	0.74
1170.9104000	0.27
1182.8514400	0.82
1191.1284180	0.70
1199.5554200	5.05
1200.3487550	2.54
1216.7586670	2.17
1217.7279050	0.16
1236.6960450	0.46
1238.6474610	0.53
1257.7926030	0.16
1276.8375240	0.57
1278.9934080	0.23
1294.8206790	0.96
1296.1148680	3.75
1296.8991700	0.45
1298.9627690	0.61
1302.9896240	0.56
1312.7205810	1.88
1327.7507320	0.83
1344.4984130	0.78
1345.8753660	0.63
1346.7376710	0.19
1357.6210940	0.19
1405.5468750	0.91
1414.2110600	0.94
1423.7120360	1.14
1425.8995360	0.77
1429.6486820	2.10
1430.3023680	0.32
1431.1358640	0.17
1432.3944090	0.76
1443.8641360	0.23
1488.8789060	0.56
1518.4362790	0.26
1523.2242430	0.62
1532.9656980	0.44
1554.4736330	0.51
1607.6551510	0.38
1634.1046140	0.56
1638.1437990	0.22
1639.6711430	0.14
1643.1390380	0.51
1649.7980960	4.18
1670.0998540	0.47
1674.9737550	0.78
1702.2536620	0.62
1705.8908690	0.77
1711.3054200	0.31
1713.8713380	0.16
1718.9273680	1.56
1720.2023930	0.56
1721.2297360	0.19
1733.0657960	1.03
1740.3371580	0.16
1747.0860600	0.44
1749.0075680	0.60
1765.2102050	0.28
1767.6717530	0.92
1769.1867680	0.60
1773.7131350	0.47
1777.1656490	0.32
1780.8450930	0.16
1783.3118900	0.17
1786.0347900	3.22
1790.0905760	0.55
1790.8101810	5.49
1800.3963620	0.80
1801.3342290	0.80
1806.3721920	0.41
1810.0159910	2.15
1811.8883060	0.43
1814.2742920	0.69
1816.7318120	5.01
1818.1732180	0.24
1824.0794680	0.32
1826.7139890	0.23
1827.8909910	0.24
1828.9577640	12.69
1829.7979740	0.16
1831.9608150	0.30
1834.3287350	0.85
1835.2911380	0.53
1837.8454590	1.52
1839.4304200	0.21
1841.2281490	4.12
1842.5731200	0.30
1846.0124510	0.84
1848.9088130	0.37
1850.3963620	0.23
1855.3843990	1.06
1856.5036620	0.14
1857.4356690	1.17
1858.0944820	0.37
1859.2557370	1.13
1860.7482910	0.89
1861.9229740	0.92
1864.3060300	3.78
1866.1760250	6.59
1866.9422610	8.88
1872.3524170	0.61
1873.4630130	0.14
1874.9201660	0.40
1879.2653810	1.82
1880.2863770	1.11
1881.5921630	0.43
1885.0728760	0.28
1885.7442630	4.64
1887.4646000	3.58
1888.6397710	0.79
1891.1281740	1.50
1892.4610600	2.92
1895.2362060	0.52
1897.7813720	0.32
1899.8214110	0.56
1901.4017330	0.72
1904.2662350	2.56
1906.1208500	1.59
1906.9722900	0.65
1911.7530520	1.96
1912.9139400	2.82
1913.7669680	0.19
1914.3796390	0.78
1915.2215580	0.14
1916.3824460	5.58
1917.5701900	47.82
1918.4704590	0.46
1919.6149900	2.66
1921.7263180	1.33
1922.7540280	1.57
1924.5970460	0.34
1926.1510010	0.12
1927.6888430	4.30
1928.6380620	2.42
1929.7652590	0.21
1931.4110110	0.21
1932.5733640	7.74
1935.4962160	0.30
1937.5745850	0.58
1940.0651860	28.24
1942.2503660	0.23
1945.3322750	1.85
1946.2615970	2.25
1947.0671390	0.50
1948.4553220	1.06
1950.2907710	1.69
1952.5584720	3.75
1953.7764890	1.43
1955.3087160	18.78
1959.3503420	1.81
1960.5772710	0.81
1961.6002200	7.42
1963.0572510	3.84
1963.6926270	3.43
1965.0721440	4.12
1965.9344480	1.55
1968.2147220	1.47
1968.8519290	2.64
1969.8181150	5.43
1970.9171140	9.61
1972.4211430	3.83
1974.6817630	0.86
1976.9621580	14.65
1977.7845460	22.41
1978.6311040	6.73
1979.5596920	10.84
1980.6412350	0.46
1981.5816650	0.14
1985.5203860	2.32
1987.9147950	4.10
1988.5548100	5.69
1989.3708500	14.31
1990.7493900	4.80
1991.4528810	4.32
1992.0701900	43.71
1993.1076660	1.17
1994.8934330	1.70
1995.9688720	0.58
1997.0448000	0.65
1998.2862550	1.37
1998.9432370	5.89
1999.9141850	1.73
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	329.0876
Annotation	1-O-Vanilloyl-beta-D-glucose
Peak:m/z	Relative Intensity
107.9807129	0.91
123.1132965	1.24
152.0229797	4.05
167.0251007	100.00
178.9785614	0.14
185.0251312	0.13
195.1850586	0.08
206.8680115	0.07
213.3888245	0.44
215.099823	0.11
241.155426	0.53
242.9385376	0.17
253.4035034	0.14
257.2207031	0.18
261.290802	0.14
265.8260498	0.17
282.9379578	2.87
283.6083069	0.04
285.1726074	0.58
291.1878052	0.11
293.2317505	1.40
297.0621948	0.26
301.1720581	0.23
308.9738159	0.10
310.4757996	0.29
311.3925476	0.36
328.9555664	0.42
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	345.0826
Annotation	Pseudolaroside A
Peak:m/z	Relative Intensity
113.0975342	0.05
120.0499268	0.09
136.9960632	2.95
161.1012573	0.04
164.2872925	0.11
165.0488281	0.10
169.2561340	0.07
179.0607910	0.11
180.0568390	0.04
191.0654755	0.07
214.1084290	0.18
223.0853882	0.07
253.1151733	0.04
259.2879944	0.04
260.9714661	0.02
273.2985229	0.05
281.2199402	0.03
299.1301270	100.00
300.3382874	0.06
301.1473999	0.22
307.1237488	0.05
308.2741699	0.06
309.1680908	0.09
316.0970459	0.06
325.1332397	0.13
327.2355957	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	448.83
Annotation	Unknow
Peak:m/z	Relative Intensity
128.9618225	0.35
196.1278687	0.06
196.9478760	2.86
280.2557373	0.92
280.9191589	25.12
286.9634399	0.89
293.1293640	0.06
296.8974609	3.22
304.8859863	0.06
329.0477600	0.14
341.1421509	0.15
362.9807434	0.17
364.6685791	100.00
365.2860107	1.07
376.8604431	0.20
380.5418396	0.80
385.1587830	0.17
388.8288879	0.30
393.0590210	0.19
402.6325378	0.12
430.9862976	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	551.183
Annotation	Unknow
Peak:m/z	Relative Intensity
159.0953064	0.43
160.0058136	0.01
165.9674530	0.00
173.1968079	0.00
177.2283630	0.03
190.9523010	0.12
207.2397461	0.02
209.0892944	100.00
210.1214905	3.61
211.1361847	0.01
253.0639343	0.00
280.3229370	0.00
289.1812439	0.06
300.9174194	0.00
324.1735229	0.01
324.8955688	0.00
327.1280518	0.00
341.5823364	0.01
359.3739624	0.00
360.2628174	0.01
397.3650513	0.01
451.4547729	0.00
454.2367554	0.02
505.3278809	0.01
507.1635742	0.00
518.1881714	0.00
533.1608276	0.00
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
101.0860519	0.55
106.9436264	0.42
109.0633163	0.83
111.0058899	0.51
123.0453262	2.63
125.0020981	0.30
126.8461151	0.35
135.0432129	1.22
136.9605103	0.76
139.0667267	1.53
143.151001	2.21
146.8969421	0.51
153.0551758	0.32
155.0719604	1.68
160.9715424	0.30
163.113739	0.84
164.9263916	1.81
166.9455109	1.25
168.9124146	0.45
171.1708069	1.13
177.2736511	0.45
178.8913574	0.81
180.9408722	0.84
183.1630249	0.32
185.1329346	0.86
190.9635468	1.34
192.2100525	0.42
197.1400146	1.57
199.0269318	1.61
201.2330933	0.57
203.2575684	0.74
206.9837036	2.81
211.1829834	0.30
213.2854309	1.50
214.1896057	0.30
215.0299377	0.66
219.2284546	0.49
222.977478	0.28
223.9095154	0.57
225.2075806	0.88
227.2635193	2.04
235.6011658	0.30
237.3791504	0.27
239.0866089	2.07
240.2921448	0.25
241.1792603	0.71
242.9934082	0.40
246.9860535	1.11
251.4231567	1.79
252.5924683	0.30
253.1966553	2.43
255.1597595	1.73
257.463562	0.98
265.2381287	2.00
269.0847168	1.29
275.2518311	9.44
278.9890747	0.42
281.2940369	0.65
283.3023376	0.66
293.2054749	100.00
302.1763611	6.31
310.2789001	0.84
311.2444458	0.35
322.9761658	0.92
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	565.2288
Annotation	16-Hydroxymilolide M
Peak:m/z	Relative Intensity
191.0486145	0.02
204.8663177	0.02
207.2579498	0.02
268.5868530	0.02
272.4327698	0.02
278.3532104	0.01
279.2386475	0.01
298.3475342	0.02
308.3458862	0.01
313.2419434	0.01
322.0209961	0.01
323.1779785	0.08
327.5166626	0.02
330.5211792	0.01
338.4102783	0.06
339.2135620	0.08
346.4902344	0.07
347.1444702	0.01
353.0969238	0.01
357.1210938	0.03
358.1364746	0.01
361.3247681	100.00
362.3057861	14.34
363.2630615	0.02
366.1793823	0.01
374.3486938	0.01
381.2401123	0.01
384.6065063	0.01
385.2647095	0.04
389.2872314	0.02
403.3309326	0.67
404.2713623	0.16
434.4660645	0.04
449.3317871	0.01
463.2007446	0.08
467.2402954	0.01
469.6749878	0.06
473.3544922	0.02
476.2532349	0.06
477.2609863	0.08
478.7678223	0.01
481.2199097	0.02
505.2852783	2.64
506.3094482	0.58
519.5057983	0.40
520.5208130	0.03
521.9118042	0.09
523.2479248	1.45
524.2848511	0.27
529.3759155	0.02
530.0938721	0.01
531.2597046	0.02
536.4987183	0.02
547.3256226	0.10
548.2343140	0.02
564.0382690	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	662.73
Annotation	Unknow
Peak:m/z	Relative Intensity
206.8415375	0.83
274.8949585	2.53
290.7268677	2.32
342.3707275	0.93
343.1743774	0.33
358.8236694	3.06
362.1164551	0.47
364.3585815	0.60
374.8628540	0.64
381.0900269	0.27
401.3153687	0.48
402.2404785	0.54
410.7769165	3.02
426.6825562	18.67
432.3881836	0.24
436.8748779	0.95
441.7188721	0.44
442.6502075	3.88
444.3823242	0.18
452.8994141	0.32
454.8776245	0.33
458.7868042	0.49
464.0578613	0.17
481.1307983	0.31
488.2656860	0.22
494.7440796	28.58
496.8336182	2.27
498.9699707	0.19
507.6258545	0.42
509.1412354	0.22
510.6305542	100.00
511.4561157	0.77
519.1356812	0.35
526.6962891	26.69
531.8114624	0.39
543.0782471	0.16
549.4388428	0.26
556.2369995	3.52
556.8499146	23.03
576.1071167	1.12
576.8604126	1.15
578.2487183	19.01
578.8544312	57.92
593.0521851	0.62
594.7362671	11.21
595.5033569	1.77
598.6359253	1.68
602.4739990	2.41
603.3444214	0.62
616.1331787	8.86
616.9835815	8.13
643.8857422	1.13
644.5089111	0.73
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	342.86
Annotation	Unknow
Peak:m/z	Relative Intensity
122.9285736	0.90
190.9259033	3.46
207.0363922	27.42
258.8953247	96.77
274.7843323	100.00
295.0424805	0.09
301.1331482	0.13
324.3854370	0.23
325.1306763	0.36
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1089
Annotation	5-O-(alpha-Mannosyl)-myo-inositol
Peak:m/z	Relative Intensity
89.12301636	0.11
96.97671509	0.48
100.9988174	6.50
106.8088303	1.14
112.8970108	14.64
115.0068359	0.80
117.6672516	0.24
118.9932404	12.69
125.0867004	2.47
130.9519043	4.37
143.0392151	16.15
148.8920593	4.09
155.1737976	0.07
160.9890594	19.85
177.1190948	0.32
179.0627747	100.00
221.1820679	0.38
234.1637878	0.25
241.9209595	0.18
245.2225647	0.19
249.3535767	0.33
250.8058167	0.11
252.1391602	0.23
280.0462036	0.41
281.0991211	1.69
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	521.3015
Annotation	Unknow
Peak:m/z	Relative Intensity
155.2327728	0.82
157.2868042	0.87
171.3867645	0.46
174.8899078	0.35
177.2327576	0.59
184.0375366	0.92
189.1480103	9.35
199.0736694	1.20
207.1706085	7.53
217.0737305	3.13
235.1171875	5.96
236.1945648	1.87
253.4532166	0.87
310.9464111	1.20
362.5325317	0.25
363.4628906	0.26
393.4113159	0.37
444.1635742	0.39
470.0440063	0.27
471.0388794	2.67
472.3110962	0.20
473.0244751	1.17
486.9899902	0.20
503.4801636	0.93
521.2072144	0.14
707.0380249	3.41
807.3289185	100.00
808.3630371	34.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	441.1721
Annotation	2-[4-(3-Hydroxypropyl)-2-methoxyphenoxy]-1,3-propanediol 1-glucoside
Peak:m/z	Relative Intensity
228.5431213	0.09
241.1449890	0.18
243.1804199	0.12
245.1495056	2.03
270.3516541	0.13
284.9108276	0.25
286.8807373	0.22
289.0838013	6.69
293.1015930	0.15
297.3292236	0.15
307.2791443	0.12
324.2865601	0.18
329.1523438	0.13
347.3325806	0.32
355.3104858	3.94
379.4905396	0.71
395.3090515	0.66
397.3598328	100.00
411.1739502	0.19
423.2193298	6.42
424.3352966	0.33
427.3688049	0.14
441.1020203	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.109
Annotation	Lactulose
Peak:m/z	Relative Intensity
99.0506821	0.29
100.9147034	9.66
112.9846344	15.29
116.8812866	0.18
118.9665527	12.34
125.0167236	2.11
126.8711166	0.77
128.9172516	0.32
130.8420563	8.55
142.9733429	21.47
149.0613403	3.67
161.0826416	23.51
179.0127563	100.00
220.5010376	0.74
280.9587402	1.58
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	564.3311
Annotation	Unknow
Peak:m/z	Relative Intensity
189.2872314	0.03
201.6698914	0.03
242.0364685	0.02
243.1521912	0.06
279.4281006	0.33
280.5184021	0.02
306.2240601	0.03
379.2977905	0.02
403.2016602	0.02
411.2166748	0.04
415.4129028	0.16
445.2669067	0.04
449.6437988	0.02
459.5665894	0.05
468.1032715	0.04
469.3707275	0.01
487.4683228	0.04
499.4613647	0.03
502.1144409	0.01
504.4437256	100.00
505.4466553	9.82
506.3519897	0.01
518.6224976	0.01
520.5373535	0.03
528.0552979	0.01
545.9971313	0.04
547.9125366	0.05
559.6095581	0.04
563.6381226	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	518.32
Annotation	PC(18:3(6Z,9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
177.0175629	0.65
183.9906769	17.76
239.0622101	0.30
287.5333862	0.32
291.1636658	1.91
292.2590332	1.37
305.2090454	0.38
323.3844604	0.44
324.2476807	2.95
347.7343140	1.13
357.5782471	1.70
370.3710327	0.46
380.8991089	0.53
412.0201416	0.18
426.0858765	0.69
430.3800659	0.27
431.8064575	1.46
452.0064087	0.28
483.1542358	0.34
487.0617676	0.71
490.6271362	0.26
500.5007324	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	527.0828
Annotation	Unknow
Peak:m/z	Relative Intensity
159.0267792	0.03
179.1268616	1.68
185.0376892	2.25
203.0240326	8.79
205.0949402	0.07
215.1318817	0.02
241.3261566	0.01
259.1945801	0.09
271.2261963	0.02
297.3178711	0.13
303.4262085	0.03
317.3156738	0.02
321.4272461	0.02
335.2281494	0.05
341.1889038	0.55
343.4533081	0.02
346.6244507	0.02
347.2680664	0.22
365.1005859	100.00
365.9874878	0.04
367.5391846	0.03
385.1661987	0.01
391.4990234	0.02
473.1676636	0.01
481.4145508	0.05
483.5607910	0.10
491.3397827	0.02
508.5258179	0.01
512.2561646	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	663.1994
Annotation	Unknow
Peak:m/z	Relative Intensity
214.9529572	0.07
217.1920471	0.70
303.1681519	33.81
315.2638550	0.12
321.0621338	100.00
321.6695557	0.17
340.9949341	0.17
346.3309326	0.16
377.1931763	0.24
380.3771973	0.19
381.0144043	0.06
471.4407349	0.11
487.9531250	0.21
489.2322388	0.18
493.3124390	0.10
546.1356201	0.10
548.3644409	0.09
555.3619995	0.09
558.4308472	0.27
559.2747192	0.21
563.8828735	0.16
615.4612427	0.11
617.1314087	0.17
627.3878784	0.06
629.4744263	0.12
645.2212524	0.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	651.1633
Annotation	trans-delta-Viniferin 3''-glucoside
Peak:m/z	Relative Intensity
227.2520905	0.03
285.2669678	0.01
319.1178589	0.06
335.9719238	0.03
339.3071899	0.03
367.3035889	0.04
373.1267090	0.05
377.3348999	0.03
409.4084473	0.03
425.1055298	0.02
433.3062134	0.04
449.4173584	0.07
461.1504517	0.06
463.1960449	0.07
469.5819092	0.07
483.5014648	0.07
487.8468018	0.03
503.6183472	0.02
522.2354736	0.04
539.2011108	0.05
547.7542114	0.05
554.3658447	0.04
567.2832642	0.08
583.2125854	0.04
604.7167358	0.11
607.5654907	0.18
609.6096802	0.16
613.3165894	0.19
615.3494263	100.00
616.0045776	0.19
617.4478149	0.05
622.2763672	0.05
623.4403076	0.09
632.3062134	0.03
633.4813232	0.08
635.9108276	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	563.1767
Annotation	Hymenoside E
Peak:m/z	Relative Intensity
207.0865173	2.65
220.5156097	0.08
268.1287842	0.31
290.2632141	0.21
305.4266663	0.08
306.4562073	0.26
307.5794067	0.17
308.3135986	0.06
310.2293091	0.07
321.9510498	0.27
323.1572876	0.59
325.2107544	32.99
326.2711792	6.65
329.2320557	0.44
337.1853027	100.00
338.2711792	18.02
341.1089478	0.03
354.3120728	4.24
354.9905396	22.26
356.0825806	4.04
359.2230225	3.67
360.3049927	0.34
415.2601318	0.08
456.7780762	0.04
461.4963989	0.03
467.6377563	0.10
487.2260132	0.14
490.2586060	0.07
491.4448242	0.18
501.0990601	0.09
503.3311157	4.32
504.2440186	0.54
507.2761841	0.34
517.5106812	0.54
518.3755493	0.04
519.3742676	0.04
520.4027710	0.23
521.3866577	0.46
522.4669800	0.19
526.4335327	0.21
527.0736694	0.04
528.1308594	0.29
545.5785522	0.09
546.5007935	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	409.1859
Annotation	Vernoflexuoside
Peak:m/z	Relative Intensity
146.0982056	3.16
188.1217651	27.11
205.1001587	100.00
244.1426392	0.37
247.4577332	0.18
282.4055176	0.85
301.2130432	0.22
302.1197510	1.36
311.2822266	0.53
317.9494019	1.08
320.1044312	1.16
324.3760681	1.10
334.1521301	0.92
356.7360229	1.85
363.2580261	0.89
372.6929016	0.39
377.3632507	0.10
386.3132629	0.25
391.1238708	2.35
392.2257996	1.52
399.8354492	0.91
400.7947083	1.32
409.5555115	1.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	281.14
Annotation	Qing Hau Sau
Peak:m/z	Relative Intensity
87.03300476	0.09
94.83457947	0.03
96.82269287	0.10
110.9412766	0.32
119.0043793	0.61
120.9261475	0.13
123.0559616	6.03
125.1631165	0.10
133.177887	0.29
134.9795837	0.22
137.0505981	0.25
137.9358521	0.14
138.8822784	0.03
140.9075317	0.04
143.0788269	0.11
145.0682983	1.25
149.0346069	0.09
150.924118	0.04
153.1009216	1.86
159.1007538	0.36
163.2327881	0.10
169.0262756	0.13
171.1040497	9.90
175.0574951	0.29
177.9161377	0.14
179.2109985	0.11
180.1326294	0.04
189.196167	3.42
191.2745056	0.31
193.0762329	38.66
195.2989807	0.04
199.0679321	0.03
201.178833	4.70
204.1398315	0.08
205.1605225	0.07
207.1100769	7.19
219.1246948	10.84
220.0826721	0.03
235.100647	1.27
237.1447754	100.00
238.1585999	0.05
244.305481	0.06
245.2297058	0.15
251.1006775	0.23
253.2540283	0.04
261.2915039	0.09
261.9530945	0.13
263.0997925	1.11
264.2149048	0.05
265.0175781	0.05
267.0800171	0.03
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
200.1558533	0.14
229.7657166	0.24
233.8061981	0.04
273.0261230	8.93
274.0213623	3.65
275.0809326	3.82
277.2896729	0.18
387.0848389	15.12
388.0208740	10.76
389.0694580	11.94
389.9750977	0.04
454.9082642	0.07
460.1184692	0.09
462.9595337	0.06
485.1390991	0.10
486.3696289	0.15
500.9976807	49.16
501.9853516	82.39
502.9694214	100.00
503.5889893	0.28
505.2349243	0.06
510.0899048	0.12
513.8568726	0.14
515.0226440	0.11
527.4619141	0.10
560.3137207	0.08
570.1621704	0.08
571.0818481	0.77
572.7649536	0.28
583.9138794	0.11
585.3023071	0.24
588.9738770	0.05
599.2101440	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	425.1662
Annotation	3-Methyl-3-butenyl apiosyl-(1->6)-glucoside
Peak:m/z	Relative Intensity
131.1266479	0.07
144.0446777	0.38
160.9079590	0.05
177.0449219	0.06
195.0654449	0.06
219.9818420	0.06
245.0484009	0.04
263.2279358	0.15
293.3948059	0.15
323.0390320	0.08
324.1398315	0.12
331.2434082	0.06
333.2542419	0.06
335.0894165	0.06
338.3342285	0.22
347.2325439	0.20
353.3419189	0.05
357.0669861	0.32
361.4814758	0.17
363.4581299	0.23
364.2536926	0.08
366.3401794	0.15
375.4363098	0.06
377.2319336	0.09
379.2901917	100.00
380.9656677	0.20
383.1582336	0.11
396.6408997	0.05
406.5174561	0.18
407.4516296	0.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	348.85
Annotation	Unknow
Peak:m/z	Relative Intensity
128.6678162	0.08
174.9043274	0.18
180.9295044	1.58
213.2940979	0.10
251.3101501	0.17
259.0762024	0.26
264.8058472	13.79
279.9003906	0.24
281.3794556	0.12
302.9718323	100.00
304.2695923	0.28
307.2397461	0.23
319.2919922	0.21
330.7939758	21.38
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	653.2029
Annotation	Unknow
Peak:m/z	Relative Intensity
193.1403351	9.50
197.0762787	0.62
235.1167908	0.29
280.2736206	0.29
283.5272522	0.39
289.0860291	0.18
292.1712646	0.16
294.3496094	0.60
295.1776123	0.99
309.3561707	0.93
311.0040894	0.43
320.9748535	0.23
325.0834351	0.19
383.6472168	0.17
397.4517822	1.95
400.1615601	0.70
415.3834839	38.37
427.5070190	0.60
459.3118896	100.00
470.2677612	0.14
471.3295288	25.13
501.2754517	2.47
505.4068604	0.57
515.1057129	29.80
517.6880493	0.74
542.8399048	0.15
574.3937378	0.13
591.6943970	0.38
608.8747559	0.70
644.3644409	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	564.331
Annotation	Unknow
Peak:m/z	Relative Intensity
225.1119690	0.01
241.8511810	0.04
279.3811035	1.42
280.4468994	0.13
299.2147827	0.03
353.2833862	0.02
422.1237183	0.01
433.6965332	0.02
459.5915527	0.03
468.4572144	0.05
474.6026611	0.01
483.1317749	0.08
484.3640137	0.03
488.4496460	0.01
493.7207642	0.05
504.3901978	100.00
505.3461914	11.31
506.2769165	0.23
509.5895386	0.08
510.9817505	0.01
517.0708618	0.03
519.2096558	0.02
526.2622681	0.01
528.1705933	0.04
536.5986328	0.02
543.2903442	0.13
546.3734131	0.01
547.5407104	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	522.77
Annotation	Unknow
Peak:m/z	Relative Intensity
241.1040039	0.02
270.9742432	0.66
276.9296875	0.05
280.1091614	0.06
287.1765747	0.12
292.9801025	0.11
303.0463867	0.04
308.9262085	0.42
310.9151611	0.57
340.8953247	0.29
341.9061279	0.07
343.0728760	0.10
344.4461060	0.06
346.2385254	0.05
347.2097168	0.05
354.2603149	0.32
354.9312134	9.04
361.1682739	0.22
364.3444824	0.05
370.9467163	1.38
373.1187744	0.16
379.0850830	0.10
382.2057495	0.02
389.8691406	0.02
403.1002808	0.29
412.1359253	0.05
413.0433350	0.06
422.9979248	0.02
432.8540039	0.02
433.8245850	0.05
436.9784546	0.50
438.7170410	100.00
439.3565063	0.56
450.9748535	0.03
454.8354492	2.36
461.7296753	0.04
463.0302124	0.21
466.9347534	0.18
476.0557251	0.12
477.1315918	0.02
481.1710815	0.05
488.0419312	0.09
505.8567505	0.65
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	583.2029
Annotation	Sylvestroside IV
Peak:m/z	Relative Intensity
165.0907135	0.05
179.1541901	0.23
195.2182007	0.84
208.9405670	0.03
234.6978607	0.03
291.4204712	0.03
298.0358276	0.04
327.2432251	11.48
328.3104248	1.23
345.1260986	0.22
356.6591187	0.17
357.6575928	0.11
358.3505859	0.21
364.9191284	0.03
369.0814819	0.06
375.1463013	100.00
376.1087036	8.33
385.4234619	0.09
387.3602295	0.05
395.2078247	0.02
417.1237793	0.12
421.3776855	0.21
459.3076782	0.83
460.6101685	0.24
467.5361328	0.02
477.4534912	0.03
480.4615479	0.02
488.5526123	0.04
498.4329834	0.09
505.3315430	0.02
519.2897339	0.12
521.2041626	0.07
523.1967773	0.04
534.4260254	0.06
536.3004761	2.14
536.9058228	27.86
537.9338989	2.12
547.3441162	0.04
563.3106079	0.04
565.3898315	0.07
566.5326538	0.06
575.6908569	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1086
Annotation	5-O-(alpha-Mannosyl)-myo-inositol
Peak:m/z	Relative Intensity
99.06060791	0.50
101.0108719	6.87
112.9053116	20.24
116.9042587	0.94
119.0110397	18.61
125.0852356	2.31
131.0356445	6.97
142.9915771	14.65
148.3695068	0.56
149.1398315	1.74
160.9449615	30.54
165.1776123	0.81
178.4048004	7.32
179.0516663	100.00
181.1293335	1.01
193.0747986	0.79
194.9115906	0.51
226.2958984	0.63
249.176178	0.46
250.94104	1.61
253.1324768	0.45
263.2278748	1.81
266.9628906	1.55
281.0237427	8.94
284.5437317	1.19
295.3085938	10.58
297.2790833	7.02
305.4429626	2.77
308.2423706	1.22
311.2675476	0.63
323.1407166	4.61
324.0361328	3.34
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2418
Annotation	Moniliforminol A
Peak:m/z	Relative Intensity
93.03945923	0.48
94.90101624	0.57
96.932724	1.01
99.07473755	0.09
106.9694901	0.27
109.0661087	0.84
110.8746872	0.68
113.0534897	0.87
115.081665	0.19
120.9696655	0.68
123.1189499	1.99
125.1094284	0.49
126.993721	0.71
133.1504517	0.50
135.1362152	0.90
136.9785461	0.39
138.9655457	2.38
141.0700378	0.26
143.1851196	0.18
144.7582092	0.23
146.9421997	0.29
149.2285461	0.39
151.2155457	0.70
152.9943695	2.94
155.0822906	0.85
157.0376282	0.32
159.0805664	0.09
160.9568481	0.28
163.1695557	0.15
165.1958313	0.60
167.0644226	1.27
169.2268982	1.13
171.0900574	1.06
173.1594849	0.18
175.1360931	1.28
177.1144562	0.18
179.2220459	0.22
181.2600403	0.47
182.9874725	2.85
185.0480042	0.67
187.1615753	0.51
189.3829651	0.69
191.1678162	0.20
193.1026611	0.51
195.0316467	0.47
197.1247711	4.75
199.2674255	0.78
203.1492004	1.67
205.1802673	0.10
207.1912537	0.81
208.2390747	0.29
209.1785889	1.18
211.171814	3.44
213.2660828	0.96
215.1454468	0.46
217.2406921	0.85
219.3016663	1.44
221.151123	2.41
223.0793152	2.09
225.207428	3.15
227.3266296	1.40
229.227356	0.29
232.22995	0.12
233.2539978	1.97
233.9801331	0.19
235.257782	0.11
235.9865112	0.20
237.18396	6.45
239.1322021	12.43
241.4335327	0.31
242.4482422	0.15
243.1864624	1.83
245.4346313	0.27
249.2162476	0.24
251.098114	2.67
252.1732178	0.07
253.2435303	1.12
255.1587524	0.73
257.0310059	2.35
261.2815552	6.49
262.3046265	0.30
264.9197388	0.09
269.1038513	0.28
279.2369385	100.00
280.339447	0.82
281.0438843	0.10
288.0737305	0.62
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1044.4558
Annotation	Unknow
Peak:m/z	Relative Intensity
607.2911377	0.38
669.3699341	0.31
854.4362793	0.38
855.6740723	0.58
956.1159668	3.59
969.0473633	0.19
985.6762695	0.77
986.3066406	0.26
994.8333740	4.90
995.8940430	0.37
1011.6997070	2.78
1020.9465330	7.41
1034.1075440	0.68
1043.8818360	1.10
1053.7319340	0.95
1056.6630860	1.36
1059.6325680	3.11
1087.7299800	3.10
1092.3350830	4.96
1093.2517090	0.24
1101.2795410	1.59
1134.1966550	2.14
1139.0161130	3.68
1145.8537600	0.84
1163.6799320	0.24
1179.4996340	3.11
1205.6760250	1.39
1214.4627690	1.34
1219.3554690	2.17
1243.0808110	0.73
1510.5698240	0.54
1512.7791750	0.35
1517.0373540	0.28
1568.6031490	0.17
1579.7100830	0.66
1617.8177490	0.59
1632.6353760	2.49
1673.0333250	0.88
1674.7677000	0.22
1708.1693120	0.82
1712.1241460	0.68
1724.6356200	0.37
1727.4019780	0.68
1751.2376710	0.52
1763.7967530	0.33
1778.5975340	0.72
1790.1243900	1.07
1793.3225100	0.15
1800.3739010	0.29
1802.8581540	0.35
1806.4974370	0.23
1809.7967530	0.66
1813.7454830	0.47
1814.3780520	0.21
1818.2180180	0.50
1819.8226320	0.22
1823.8869630	0.80
1826.8732910	1.04
1832.7716060	0.19
1836.8885500	0.63
1845.4748540	0.47
1846.3380130	0.40
1847.5958250	0.21
1850.6794430	0.15
1861.9969480	0.50
1867.0799560	0.68
1868.7139890	0.32
1869.6086430	1.00
1874.9649660	0.19
1875.8677980	0.28
1876.7191160	0.21
1878.5994870	0.90
1882.3190920	0.74
1884.6706540	1.44
1885.3143310	0.41
1886.6901860	0.69
1891.0382080	14.15
1893.3389890	0.26
1899.1970210	0.47
1902.0134280	11.23
1910.3995360	1.66
1914.0031740	29.02
1915.0267330	0.24
1915.9190670	0.68
1916.9083250	0.22
1918.5745850	3.91
1920.0294190	0.37
1920.7042240	3.70
1921.8946530	12.24
1924.0701900	3.92
1928.3621830	2.29
1931.2073970	0.22
1932.2884520	3.27
1933.7020260	2.55
1935.1315920	1.03
1940.0828860	5.79
1941.4979250	0.72
1943.2888180	4.15
1945.7581790	1.14
1949.2044680	2.42
1950.0969240	5.97
1951.9152830	12.31
1953.5577390	0.58
1954.1766360	0.19
1955.3194580	80.95
1957.0247800	0.89
1958.7476810	3.02
1959.6754150	2.62
1960.9777830	0.88
1961.6901860	3.79
1962.7448730	16.51
1964.5491940	3.65
1965.5855710	2.62
1967.1446530	9.09
1968.4630130	59.80
1970.0682370	0.52
1972.6843260	4.35
1975.3355710	1.45
1976.2307130	24.52
1978.7606200	0.74
1980.0095210	0.99
1981.9241940	2.36
1982.7574460	100.00
1984.3992920	3.92
1985.0313720	3.94
1986.2395020	2.19
1988.0460210	9.46
1988.9600830	1.72
1990.7281490	4.94
1991.6253660	3.35
1992.5106200	11.94
1993.1983640	9.94
1996.0544430	4.95
1996.9678960	7.72
1997.5889890	0.48
1998.5635990	1.96
1999.5563960	1.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	386.1073
Annotation	Zeanoside C
Peak:m/z	Relative Intensity
118.9535675	0.91
121.1442566	0.01
123.0722809	0.80
136.0986481	4.41
146.9495697	1.65
165.0359192	13.23
180.3572693	0.02
182.0281067	100.00
204.0928345	0.11
205.2875824	0.05
208.0245056	0.03
221.9761047	0.03
237.9523315	0.02
250.0674133	0.07
264.2068481	0.07
265.2875671	0.05
270.1685181	0.02
284.1481934	0.03
287.1271667	0.10
326.2522583	0.06
327.2232361	0.09
340.3432007	0.02
344.0655823	0.02
350.3932190	0.02
365.4681702	0.07
367.4332886	0.11
368.3197327	0.09
376.6050720	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	578.77
Annotation	Unknow
Peak:m/z	Relative Intensity
206.8058014	1.12
212.8775635	0.21
216.0991058	0.12
237.2202454	0.13
258.8803406	0.25
274.6956787	1.19
286.3402100	0.54
290.8491821	3.50
305.6889648	0.21
315.6160278	0.88
343.2357178	0.97
358.9113770	1.24
384.0760498	0.18
404.3825684	0.33
404.9859009	0.35
410.6467285	8.28
423.2000732	0.38
424.3314209	0.36
426.6469116	26.22
427.3446045	0.07
440.1406250	0.13
441.0601807	1.09
442.2927856	3.83
442.9611206	3.87
478.5795898	0.14
492.5474243	0.16
494.7601929	100.00
509.0354614	0.40
510.6362915	13.18
531.9656372	11.23
533.0051880	0.85
555.3111572	0.84
555.9807129	0.37
561.3926392	0.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	501.92
Annotation	Unknow
Peak:m/z	Relative Intensity
158.9985199	4.15
159.9750671	0.65
199.0787048	0.50
200.1852112	0.08
218.2575378	0.06
228.8491364	0.76
230.0287323	0.54
272.9956055	52.92
274.1365051	17.10
385.0760498	0.09
386.9997253	100.00
387.9885254	54.93
455.0234070	0.16
474.3374634	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	458.7498
Annotation	Unknow
Peak:m/z	Relative Intensity
130.0472565	0.26
147.0264587	2.18
148.0111542	2.61
213.2471771	0.39
260.2904663	0.25
273.2543030	0.79
277.0766602	0.82
293.2874146	0.89
301.0111084	5.83
308.4087524	0.52
326.2752686	1.24
337.6851196	0.39
353.4261169	7.09
362.6403503	3.30
374.4926453	1.47
380.8344116	1.32
393.2160034	2.11
396.3227539	0.28
397.4632568	0.28
399.9832458	6.85
403.3848572	0.95
407.7688599	5.05
417.6109924	3.75
422.5612793	1.67
427.0256653	1.10
440.3711243	1.50
441.5367126	6.28
442.2202148	1.34
447.6201782	2.64
486.6238098	2.02
493.2260437	1.26
494.9971313	1.34
497.0302124	4.79
501.3800354	0.89
517.7582397	1.77
520.3178101	1.95
528.9446411	2.54
529.8675537	4.15
530.8272095	2.07
531.4332886	0.20
535.5850220	1.23
541.4208374	0.25
543.6027222	2.94
544.7891235	0.33
553.6464233	0.74
554.2813110	1.14
557.2395020	3.75
563.0506592	100.00
564.2926025	0.33
566.2420044	2.10
567.2975464	4.39
569.1230469	2.43
584.4788208	1.94
589.5374146	0.88
593.5764771	1.52
601.7702026	1.64
602.3942261	2.74
625.5256348	0.93
639.8544312	0.49
648.4063110	0.93
661.4155884	0.33
662.1331177	2.39
686.6045532	0.83
693.5567627	9.86
694.1878052	3.01
730.5796509	0.49
737.9602661	0.44
747.5209961	5.40
750.6069946	0.65
777.2155151	3.13
910.4544067	0.58
912.1065063	0.72
1056.3537600	0.68
1355.1934810	0.25
1532.2467040	0.52
1570.3629150	0.25
1614.7381590	0.44
1625.1683350	0.32
1649.7277830	0.58
1657.5279540	3.31
1663.8972170	0.93
1671.4207760	0.57
1683.5520020	0.69
1684.5975340	0.43
1685.7530520	0.31
1692.0887450	0.37
1694.7213130	0.61
1709.8729250	0.30
1711.6234130	0.59
1718.2430420	0.20
1724.7108150	1.56
1730.4669190	0.28
1734.8981930	0.57
1736.5089110	1.17
1753.7662350	0.35
1754.9007570	0.17
1755.6673580	1.57
1765.9768070	0.80
1771.3477780	0.20
1778.2940670	0.60
1786.3638920	0.41
1800.9757080	0.60
1802.7869870	0.59
1803.4602050	0.52
1807.6447750	5.38
1810.6866460	0.56
1814.1984860	0.55
1815.2149660	0.65
1818.1011960	0.37
1819.3489990	0.31
1821.0290530	0.28
1822.0305180	42.32
1830.4562990	0.25
1836.0650630	0.66
1836.8010250	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	531.06
Annotation	Unknow
Peak:m/z	Relative Intensity
276.9631348	18.97
289.1766968	2.80
306.9057617	25.29
307.9481812	0.72
308.9981079	7.58
319.0506592	1.72
336.8477173	13.10
337.5096436	0.40
351.1470337	3.94
366.8156128	2.23
369.0549927	12.86
379.3998413	2.86
396.9359741	100.00
397.8204956	0.55
519.5398560	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	374.1071
Annotation	DIMBOA-Glc
Peak:m/z	Relative Intensity
128.4069824	0.12
130.0576782	0.18
135.9993439	1.93
144.8360596	1.30
147.3411407	0.50
148.0081787	0.91
164.9870300	10.47
182.0814819	100.00
193.5204315	0.24
194.2254639	1.20
211.0782166	0.19
212.1374817	1.20
243.2283936	0.22
258.9991760	0.38
272.1434326	0.91
277.7459106	1.39
283.1533203	0.37
284.2535400	0.48
287.4533691	0.26
289.2697754	0.78
294.2201538	0.95
296.3059692	0.93
302.3393555	0.27
310.2532349	0.43
311.9780273	0.20
314.7336426	0.35
321.2864380	0.15
325.9646912	0.46
327.4358521	0.28
328.8824463	0.64
345.5687866	0.27
355.1800842	0.46
356.1661072	2.69
357.3695068	0.46
364.2002869	1.09
364.8961487	0.48
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	542.73
Annotation	Unknow
Peak:m/z	Relative Intensity
176.5908203	0.14
206.9481201	1.25
290.8478394	12.06
363.1317139	0.31
367.1586914	0.19
368.7871094	0.81
374.4323730	3.76
375.0447388	2.39
381.2737427	0.54
388.9058228	0.40
436.9293823	0.11
448.7578735	0.07
458.0558472	8.54
458.7662354	100.00
475.4932861	0.10
478.8324585	0.18
482.5651245	0.20
486.7301025	0.14
496.7130737	0.87
500.9107056	0.19
517.0503540	0.30
524.2923584	0.65
524.9922485	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	786.9293
Annotation	Unknow
Peak:m/z	Relative Intensity
238.2014008	1.61
261.4150391	0.75
284.2181702	0.96
399.4842529	2.34
478.1023560	0.53
504.3079834	0.65
511.2747803	1.82
512.4369507	0.17
520.3359985	1.83
522.0451660	0.80
541.6976929	0.70
558.3411255	1.45
643.9403687	0.19
684.5304565	1.32
692.9785767	1.33
700.3702393	0.82
709.6493530	2.20
710.5104370	0.28
743.1349487	0.62
747.5217285	5.34
752.7434692	4.22
756.7422485	3.87
757.4967651	2.75
760.8771973	1.13
771.3392944	3.36
775.2614746	5.47
776.2559204	5.51
801.0168457	1.16
803.3757935	4.74
804.9702759	1.78
810.2549438	1.63
841.9244385	5.17
847.3709717	1.93
853.6110840	0.32
857.1425171	2.93
864.9312744	2.08
873.7402954	1.08
879.5658569	3.35
884.3632202	10.07
885.9651489	2.67
889.1383667	2.71
891.2678833	0.23
895.3043823	3.84
896.6650391	0.68
902.6276855	2.44
904.8073730	3.10
907.6682739	5.05
909.1579590	1.77
909.8460083	1.96
913.7511597	1.41
914.7235718	4.79
920.2109985	2.93
928.8463745	1.20
929.8977661	1.56
931.2771606	2.98
933.7187500	9.24
935.7415161	1.78
940.9465942	10.06
941.6007690	1.60
942.9166870	2.31
945.5507202	10.24
949.7627563	0.44
951.2622070	2.20
952.3699341	4.02
962.3002319	2.38
981.2326660	1.97
1007.6991580	0.51
1019.9960330	1.18
1034.8732910	0.23
1058.5463870	1.82
1064.2269290	0.99
1083.2995610	1.33
1085.3533940	1.94
1087.3872070	1.72
1090.1018070	3.10
1100.3337400	1.97
1107.4462890	4.14
1118.3208010	2.71
1147.8759770	0.77
1152.4421390	1.06
1168.6601560	0.66
1177.2268070	0.90
1182.1953120	2.48
1222.9200440	0.30
1229.5621340	1.06
1258.5721440	0.84
1356.1253660	0.76
1420.7119140	0.27
1439.0811770	0.32
1508.4151610	0.19
1523.3731690	0.55
1626.7135010	0.42
1628.4354250	0.25
1686.3612060	4.93
1708.6345210	0.25
1718.2535400	0.21
1728.9913330	0.25
1736.6138920	0.87
1737.5231930	0.96
1754.9440920	0.25
1759.3836670	1.61
1766.3186040	0.79
1769.9844970	8.81
1770.9486080	0.25
1774.3299560	0.24
1776.1964110	1.21
1784.2244870	0.28
1789.0938720	0.72
1794.3785400	2.69
1801.0084230	0.51
1808.3790280	0.38
1810.3660890	5.64
1811.8659670	15.44
1823.8782960	0.28
1824.9156490	1.18
1827.6512450	1.00
1830.3541260	1.33
1832.5910640	8.21
1833.3636470	1.03
1838.0897220	0.25
1841.4859620	0.19
1842.3253170	0.44
1849.5140380	0.60
1851.1251220	3.56
1856.5358890	0.48
1860.3023680	100.00
1865.0402830	1.04
1866.4328610	0.36
1867.0804440	1.18
1868.5474850	0.37
1869.5101320	0.23
1874.8177490	2.62
1876.0318600	0.57
1879.3093260	1.75
1881.7053220	0.61
1883.6981200	0.74
1886.3070070	6.11
1890.5230710	1.14
1892.8045650	1.67
1895.7585450	3.04
1899.8016360	0.42
1903.4073490	0.57
1904.4460450	0.90
1905.0933840	0.51
1907.7452390	1.44
1908.8596190	1.54
1910.4914550	1.33
1912.3380130	0.66
1913.1262210	0.30
1915.1857910	1.18
1916.8879390	0.72
1917.7391360	2.02
1920.1466060	1.04
1921.9549560	0.15
1924.6968990	3.84
1928.7136230	14.18
1929.3499760	0.27
1932.5262450	12.06
1935.0892330	8.38
1937.4068600	1.81
1940.3841550	1.69
1941.4805910	30.41
1943.8864750	2.28
1946.8780520	11.98
1948.0709230	10.08
1948.8226320	0.50
1949.7181400	6.37
1951.5845950	0.17
1953.2537840	2.23
1954.0545650	1.92
1954.6656490	8.27
1956.0491940	9.77
1958.2208250	15.87
1959.4989010	10.74
1961.5194090	3.67
1962.4373780	1.66
1963.9547120	6.13
1965.6370850	4.10
1966.5535890	32.90
1969.3494870	43.13
1970.3004150	2.59
1971.9621580	43.05
1973.8494870	24.57
1974.9600830	12.06
1975.7357180	12.85
1976.6568600	1.24
1977.5030520	1.71
1979.8099370	1.40
1981.3262940	83.09
1982.7989500	0.95
1983.7967530	2.68
1985.3396000	15.20
1986.6663820	0.63
1989.2313230	0.19
1991.0936280	2.50
1992.4569090	2.32
1993.7479250	38.99
1995.5030520	2.82
1997.1916500	26.19
1998.0456540	33.95
1999.0383300	57.58
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	578.77
Annotation	Unknow
Peak:m/z	Relative Intensity
148.8450928	0.15
176.9715424	0.09
206.9552460	0.16
236.9708862	0.07
258.8657837	0.40
274.8720398	3.14
290.8530884	2.68
310.8505859	0.11
326.4891968	0.09
342.9033203	0.89
352.7493286	0.33
358.6138916	1.30
370.8834839	0.18
399.2408447	1.92
404.5906372	0.05
405.3154907	0.11
410.3101807	0.57
410.9153442	5.48
412.8923340	0.43
417.3494263	0.06
426.7144165	25.65
427.3515625	0.32
442.0609741	1.11
442.7822876	6.08
449.1521606	0.07
458.8587646	0.24
472.7568970	13.91
473.4287720	0.11
489.0898438	0.06
494.7346802	100.00
495.4177856	0.14
510.7346802	16.46
514.6188965	0.86
517.7457886	0.10
518.8767700	2.15
532.2562256	2.85
532.8742676	6.65
561.4707642	0.06
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
149.0214233	100.00
150.0084229	26.04
167.0328369	27.03
167.8056946	13.64
260.6793213	28.38
261.5970459	15.42
278.9547119	47.14
279.8951721	28.53
313.8336182	17.06
375.2697449	40.68
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	374.1072
Annotation	DIMBOA-Glc
Peak:m/z	Relative Intensity
116.1720734	0.46
118.8886795	0.34
122.9047852	0.22
123.9445953	0.08
134.7652893	0.42
136.0714417	4.84
147.0033875	1.20
147.7644501	0.24
150.0230560	0.65
164.8849182	10.83
173.1844482	0.18
182.1123810	100.00
193.9290771	0.24
194.8109741	0.17
196.8904419	0.25
198.0734558	0.49
210.9511719	0.28
212.2153473	0.44
227.2361450	0.28
228.0856934	0.26
242.0855713	0.26
244.3372803	0.22
249.1434326	0.19
257.1366272	0.63
258.8621216	0.86
274.3277588	0.15
276.3392944	0.17
299.1643372	0.78
302.3983459	0.15
317.9983215	0.45
320.1430664	0.18
325.5113220	0.28
327.3828430	0.15
337.1430054	0.11
339.8127441	0.59
355.2840881	1.66
356.2437134	5.65
364.9408569	0.90
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	467.3309
Annotation	Unknow
Peak:m/z	Relative Intensity
147.0073090	0.63
155.1127930	0.96
156.7975922	0.91
164.9305725	1.27
165.9886627	0.53
167.0709686	1.89
168.8332977	0.42
171.0718536	0.66
174.9718323	0.86
179.0730896	2.11
183.4132385	0.25
187.2320251	0.37
191.0963135	1.69
192.0287781	1.26
193.2597046	2.17
194.1391602	1.26
195.2471771	0.37
201.2274475	1.19
202.1383972	2.49
203.0792236	6.26
204.1814575	0.73
205.0843201	1.30
207.2823792	1.05
209.0861053	1.19
211.0301208	0.56
213.3627777	3.45
215.1213837	8.84
215.9834137	0.46
217.0126038	8.10
219.2268829	2.45
220.1753998	1.65
221.1549530	3.80
223.2866516	2.59
225.2750244	1.49
226.4532166	3.38
227.3319092	2.86
228.1716614	1.96
229.1041260	5.44
231.0831757	0.78
232.1976929	1.56
233.3259125	2.37
234.2617645	0.82
235.1961975	1.13
237.2611084	0.79
239.2047272	2.04
240.1522064	1.13
241.1390991	13.25
242.2590637	5.27
243.2254028	10.14
245.1734619	12.42
246.3969116	0.37
251.4602051	2.38
252.2309265	1.90
253.2662048	6.89
255.2354431	16.11
256.3897705	8.35
257.2365417	13.58
257.9253540	0.88
259.2811890	4.50
260.5176086	0.82
261.2460022	1.94
262.3944397	1.41
263.2709045	2.44
264.0774841	0.31
265.2574463	0.58
266.3536682	2.31
267.3040466	11.37
268.5471191	2.58
269.3364563	11.93
270.5336609	5.33
271.2391663	25.64
273.3136597	6.03
274.0922852	0.93
275.1856995	2.66
277.3124084	6.73
279.1127625	5.85
281.1514282	5.71
282.2329712	1.50
283.3147278	11.14
284.0863037	11.14
285.1895447	12.02
285.8773804	0.63
287.1768494	5.23
288.3245544	1.61
289.3402710	3.62
291.3795166	3.95
292.2131958	1.11
293.3901672	1.48
294.4140930	0.93
295.3392029	3.81
296.3560181	0.94
297.2417908	8.24
298.2697754	2.82
299.2971802	11.82
300.2651978	0.99
301.4535522	5.36
303.2977295	6.26
304.4107666	0.83
305.3055420	1.13
307.3199463	1.16
308.4937134	0.40
311.2299805	10.20
312.4169312	2.53
313.3239441	14.96
315.0344238	5.83
315.6519470	1.64
317.2978210	9.32
318.2729187	1.06
319.2587280	0.45
321.3164673	1.64
323.2251587	8.70
325.3533936	21.67
326.3933105	2.44
327.3313293	7.13
328.2340088	2.38
329.3706360	6.16
330.6838379	0.34
331.3906860	4.25
335.4468384	1.23
337.3907471	5.79
338.2280273	0.28
339.2452393	30.55
340.4259033	13.51
341.4170227	39.01
342.4158325	9.58
343.3423462	7.94
344.1351318	0.46
345.2290039	1.79
347.3947144	0.81
349.2528381	1.21
350.3365479	1.08
351.4720154	15.67
352.2989807	1.29
353.3170166	15.22
354.3576660	8.15
355.4969788	26.59
356.3593140	7.99
357.2855225	13.38
358.2457581	0.34
361.4470825	0.31
363.9176636	2.39
365.3272400	14.46
367.2900696	21.12
368.3212280	37.72
369.4073486	100.00
370.4210815	12.40
371.2822571	6.22
372.3139954	0.55
373.3449097	1.88
375.6750793	0.72
377.4573059	1.86
378.3914490	1.00
379.4546814	4.35
381.3249817	8.07
382.4757385	23.63
383.4414978	48.48
384.5897217	0.62
385.3544922	8.57
389.3473816	0.40
393.6415405	5.38
395.2600403	2.46
396.3264465	14.84
397.2931213	17.43
398.3481140	0.40
399.5686951	6.22
401.3064270	6.46
402.6950378	1.24
407.3730774	0.67
408.3497620	2.64
409.4189758	2.47
410.6944275	5.38
411.5137024	10.97
412.3373108	0.67
420.7407532	0.94
421.6540833	0.64
423.3934326	12.04
424.4112854	7.04
425.4131165	11.14
426.1124268	2.22
432.2758179	0.49
433.2438660	2.66
434.2720947	6.29
435.1728821	0.43
436.1902771	1.17
437.5496521	8.57
438.3746643	6.47
439.4904480	69.74
440.4437561	1.76
441.2681274	1.76
442.2823181	2.58
443.4218140	3.14
444.2558289	0.72
447.1722717	1.94
449.4649353	78.80
450.4282532	2.51
451.4252319	0.81
452.5769348	5.12
453.4770813	2.37
463.5111389	1.02
465.6950989	3.35
467.3517456	18.51
468.1778870	19.87
469.3364563	3.75
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	311.169
Annotation	5S-HETE-d8
Peak:m/z	Relative Intensity
96.92621613	0.57
110.9996948	1.73
114.5788727	0.22
119.0950623	0.69
131.1534119	0.68
133.1907959	0.38
155.2362823	0.67
170.0808868	4.29
171.1840515	1.40
183.0035706	100.00
183.9889832	16.93
184.9935913	2.38
187.2939148	0.31
197.1417236	14.29
198.0656281	6.50
201.0712891	0.87
207.341217	1.64
210.5287476	1.12
211.1645813	1.49
213.2470398	0.63
217.3118286	0.51
222.1521606	0.67
223.0537109	0.73
225.1201172	3.67
226.1384888	3.31
227.4133301	0.78
231.3942871	0.57
234.9440002	0.32
239.3900146	3.32
240.4035339	0.71
244.9665222	0.37
247.3344421	7.24
248.3493042	0.56
249.3249817	9.44
253.1317139	2.47
254.3248291	0.84
265.3452759	2.17
266.8052979	3.88
267.4143066	4.76
268.2471924	1.90
269.3497925	0.36
270.4498901	0.92
273.3061829	0.45
275.1247559	2.31
283.3045654	0.43
293.3548889	21.58
294.3417358	0.61
295.3936157	0.56
296.028656	0.44
311.2547607	17.60
312.1878357	1.95
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	355.1014
Annotation	Chlorogenic Acid
Peak:m/z	Relative Intensity
109.1109619	1.07
122.9285736	4.46
133.0864868	1.32
163.0367737	100.00
175.255249	4.10
178.9724121	10.58
185.1304169	2.76
186.9447174	2.33
193.1119385	9.46
198.0796356	1.60
201.2943726	10.82
215.1785583	2.71
221.0601196	1.57
230.9829712	9.02
266.2161865	1.82
276.9454651	3.96
287.1329346	1.57
310.1660767	14.05
313.9808655	3.33
319.1959534	3.45
323.3339539	14.22
327.0276489	2.08
337.1221924	21.94
337.9001465	0.80
354.9261169	2.42
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	257.19
Annotation	3-Deoxyestradiol
Peak:m/z	Relative Intensity
76.88047791	9.46
82.88370514	2.30
92.77053833	0.22
94.96517944	1.85
97.08828735	0.86
100.9137802	0.50
104.8895569	0.65
106.9209747	0.34
108.9883118	1.19
111.1529083	0.45
116.6503906	0.61
118.2430725	0.49
118.8735199	0.83
120.8122559	0.17
123.1582947	1.28
124.1369324	0.53
124.9677124	1.42
127.1151123	0.40
129.0238037	4.41
130.3404083	1.19
135.2807617	0.57
136.9764099	0.76
140.9490967	1.33
143.0871735	8.46
145.127533	0.88
147.0247192	0.56
149.2958527	0.16
150.9624939	0.52
154.991684	1.45
157.0653534	9.15
159.1571808	0.20
161.0186615	1.08
167.0938568	0.77
169.0278778	1.35
171.1872559	1.09
172.3844299	0.73
173.2622223	0.18
175.4028473	0.48
177.2618561	0.25
179.0128632	7.84
181.0398254	0.85
182.8512726	0.25
187.0907288	0.83
189.0870819	0.29
191.2667694	0.54
192.6307526	1.77
193.249054	1.15
195.1461334	0.66
196.1248779	0.20
197.1375885	0.34
199.2274628	0.25
199.9676819	0.31
211.0383453	2.60
211.8807068	0.15
212.9224854	0.50
215.384201	1.55
216.0281525	0.15
221.1577911	6.59
228.9508667	1.96
236.7610626	0.26
237.9961548	0.22
239.1732025	100.00
240.184021	1.28
257.1174316	1.35
267.3078003	0.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	749.286
Annotation	Unknow
Peak:m/z	Relative Intensity
289.1745911	0.04
341.2114868	0.07
359.5593872	0.11
385.7142334	0.13
480.5270996	0.11
511.6224976	0.04
530.2788086	0.13
541.3361816	2.50
542.2861938	0.68
559.3329468	0.55
566.1589355	0.19
587.3558960	0.50
601.3101196	32.75
602.2859497	5.18
602.9264526	0.05
619.2794189	9.86
620.4514771	1.24
621.3671265	0.02
625.1713257	0.05
628.5112915	0.04
629.3657837	0.10
641.1381226	0.07
643.0399780	0.16
643.9304199	0.04
650.4208984	0.05
661.2662964	100.00
662.2766724	9.71
663.2233276	5.07
664.3630371	0.57
682.9247437	0.05
699.8997192	0.16
705.2420044	11.55
706.2221680	1.65
713.5225830	0.08
714.4451294	0.23
719.4723511	0.07
728.2816772	0.41
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.1144
Annotation	Lactulose
Peak:m/z	Relative Intensity
160.9887695	0.00
173.8550415	0.01
179.2206726	0.04
224.2532959	0.01
225.1096802	0.01
295.4622192	0.01
323.2297363	0.01
341.2030945	100.00
342.0850220	0.01
343.0636902	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	700.6442
Annotation	Unknow
Peak:m/z	Relative Intensity
213.0081940	0.73
352.8167114	0.19
370.9580078	0.35
443.7618408	1.58
460.8814697	0.52
462.8596802	0.59
478.1355591	0.17
486.5656738	0.26
524.0169067	0.48
525.0441895	0.46
525.9241943	0.47
527.2431030	0.41
528.7691040	1.50
529.6580200	1.03
530.6522827	1.42
532.0946045	3.65
532.9853516	3.34
539.9685669	1.55
545.6315918	2.02
546.5761719	0.91
547.6950073	1.43
548.7725220	0.38
550.1926880	0.19
565.4499512	1.73
570.6620483	1.41
614.7338257	1.46
616.5559082	30.26
632.9432373	2.14
635.6419678	0.51
654.6304932	100.00
655.2719727	0.66
657.6488647	4.15
658.9733276	2.22
665.0436401	0.54
676.9987183	1.45
677.6729126	0.65
682.6319580	1.81
700.7805176	1.59
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	191.02
Annotation	Diketogulonic acid
Peak:m/z	Relative Intensity
85.0310211	0.43
87.0107422	1.28
101.1267090	0.02
110.9387512	100.00
111.8543396	0.02
127.0391235	0.03
129.0121765	1.88
130.9296875	1.42
147.0330048	0.04
154.9435120	0.21
162.8856659	0.01
170.8340912	0.02
173.0031586	21.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	485.3413
Annotation	Unknow
Peak:m/z	Relative Intensity
141.0552368	0.35
145.1676178	0.59
153.1659851	0.64
154.0715027	0.30
157.1734009	0.31
159.1711426	0.87
161.1169739	0.65
164.9862671	2.77
172.9690094	0.33
179.1672363	3.78
180.1209717	0.37
181.1355286	1.59
183.1604614	2.52
185.2989502	1.00
187.2140961	0.42
188.9012451	1.25
189.9834290	0.67
191.1539001	3.54
192.1051636	0.46
193.1905518	3.75
193.9632874	0.28
195.1244202	5.90
197.0262451	0.23
198.8603821	1.29
201.9846191	3.06
203.1323853	5.11
204.3181458	1.33
205.0652771	6.04
207.1155853	2.62
209.2169800	2.47
211.1366577	1.90
213.2170868	0.29
215.1238861	6.11
216.3391571	0.80
217.1147003	11.00
218.2958832	1.96
219.1174164	6.76
221.1251068	3.34
222.8427124	1.55
225.1913300	1.84
227.1614380	1.46
228.2033386	1.96
229.0995636	5.10
230.0737457	0.79
231.1706543	4.44
233.1768494	11.38
234.1830750	2.92
235.1748199	4.94
236.2566986	0.91
237.3021851	2.60
240.3422394	3.29
241.2156830	7.15
242.0698547	0.99
243.2086487	11.97
244.1984863	2.93
245.0836639	7.43
246.7104340	7.74
247.3927612	2.26
248.2936707	0.28
249.0350037	0.39
251.2104797	3.68
252.4082031	1.83
253.1452637	2.63
254.2511292	2.15
255.2776794	4.26
256.3878784	5.07
257.3041382	8.96
258.3561401	2.84
259.1888733	10.59
260.5314331	2.45
261.3144226	8.53
262.2862854	0.37
263.2560730	4.08
265.2727966	0.58
267.4052734	2.50
268.4503174	1.10
269.3338318	3.03
270.3595581	2.23
271.1818237	6.84
273.0820312	9.99
274.4580688	1.38
275.3420715	5.21
276.2857056	1.15
277.5552368	0.19
279.3520203	1.90
281.3206787	7.22
282.2071838	1.78
283.2877808	3.52
284.4854431	3.58
285.1562500	6.03
287.3009949	11.42
288.5243835	0.61
289.4775391	0.74
290.5183105	0.31
291.3999634	3.19
293.2178955	4.56
294.3455811	0.40
295.2372437	2.30
297.4596558	6.41
298.2784424	0.97
299.2581787	4.74
300.1959229	0.74
301.2646179	6.07
302.3565369	1.42
303.3040466	5.31
304.2552490	0.23
305.3918152	6.41
307.3498230	5.45
309.0957642	1.48
311.0101929	2.22
312.2696533	1.60
313.3334045	4.15
315.2449646	7.57
316.2234192	2.15
317.3671875	9.80
319.3744202	13.50
321.4972229	3.93
323.4555054	1.89
325.2514648	4.56
326.2857056	0.61
327.3648682	6.19
328.3483887	1.64
329.3772278	12.30
330.7257080	4.09
331.3983765	14.93
333.2652588	3.78
335.2408142	2.46
336.1835022	1.01
337.3979492	4.37
338.2726440	0.45
339.3456726	14.66
340.6109009	3.19
341.3235779	17.32
343.3865356	34.31
344.4750366	2.67
345.4399719	13.14
346.3634949	3.19
347.3307800	6.86
348.3815308	0.37
349.1750488	2.98
350.3409424	1.85
351.2241821	1.21
353.4116516	1.49
354.4733887	3.42
355.4245605	8.57
357.2971802	25.45
358.3608093	8.26
359.3534851	41.59
360.3577271	1.73
361.3344727	9.29
362.4560547	0.16
363.2366943	0.85
365.5073242	1.81
366.3124390	0.41
367.5424805	3.89
368.2726440	1.84
369.3217163	19.04
370.5792847	1.45
371.3607178	7.76
372.3175964	3.81
373.3991699	18.80
374.2322083	0.78
375.5577393	2.17
376.2677002	1.13
377.4317932	1.55
378.5368652	0.70
379.4248047	2.01
380.5320740	0.32
382.0503540	4.07
383.3084412	6.65
385.2860413	7.28
386.3641663	20.98
387.3574829	24.40
388.4523926	1.20
389.5050964	1.86
392.1598206	2.01
393.5575256	0.62
395.2631226	1.58
396.8320007	6.87
397.6056824	0.97
399.4266663	6.88
400.3786316	5.85
401.4305420	15.43
402.5147095	2.22
403.4500427	3.44
404.4524536	0.64
405.6589050	1.68
407.3085327	2.32
409.7165833	0.67
410.6656189	0.32
411.4552307	2.86
413.4719849	3.44
414.5662842	4.49
415.4933167	4.66
416.3429871	1.17
417.4229431	0.98
419.4522400	2.68
420.3124695	0.69
422.2483215	1.34
425.0525513	7.63
426.0077820	1.66
427.4426575	4.97
428.4623413	3.75
429.5169373	25.37
431.3133240	0.76
437.5525818	0.84
439.4647522	10.03
441.1582642	2.49
441.9548950	0.64
443.4575195	7.78
444.4361877	1.02
445.3861694	0.57
449.5960388	6.24
451.1422119	0.64
452.1160278	0.58
453.5401917	0.46
454.2401733	0.52
455.5945740	7.07
456.5182800	3.01
457.5869446	49.69
458.4900208	1.80
459.2588501	0.30
460.0617371	0.71
465.2110291	2.52
467.4630737	100.00
468.6144104	0.88
469.3442078	0.44
483.4984741	2.17
484.3279419	1.12
485.8241577	4.74
487.1289978	2.74
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.1144
Annotation	Unknow
Peak:m/z	Relative Intensity
161.0915375	0.01
179.1127319	0.04
207.0939331	0.08
224.3005981	0.04
254.4306641	0.01
341.1852722	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.1145
Annotation	Lactulose
Peak:m/z	Relative Intensity
130.8336792	0.02
179.0344543	0.06
193.1461792	0.26
206.8384094	0.07
225.2780457	0.02
341.1966858	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	236.1488
Annotation	Unknow
Peak:m/z	Relative Intensity
73.1023178	3.31
74.9800720	20.03
82.9653625	2.73
83.9981079	1.93
84.9152908	16.17
86.9121018	29.14
92.9458237	6.62
100.8164062	2.02
101.8542633	1.19
102.8973846	14.50
104.8678436	18.24
111.1284790	0.48
118.9666901	2.64
123.0675049	0.46
130.9290314	100.00
141.0518951	0.76
144.1175995	48.23
159.0669708	21.76
162.1050568	24.21
174.1086884	0.29
180.2209015	1.38
188.1079712	1.84
190.0666504	6.73
192.2559357	0.91
199.3668976	0.50
203.0177765	0.57
208.2212372	0.90
218.1264801	34.85
227.1937714	1.69
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	805.329
Annotation	Unknow
Peak:m/z	Relative Intensity
306.1196289	0.16
335.3627625	0.03
476.3028564	0.02
514.4902344	0.02
517.5007324	0.26
551.7983398	0.13
593.4509888	0.02
599.4393921	0.11
605.7255859	0.10
607.7678223	0.10
609.4270630	0.01
610.6001587	0.05
611.2537231	0.10
637.3391724	0.15
638.5736694	0.05
639.5426636	0.03
643.4751587	0.07
650.4332886	0.89
651.3988037	0.95
652.4832153	0.17
661.0670166	0.17
662.3245850	0.08
670.5477905	0.03
671.5090332	0.10
682.4436646	1.44
683.4710083	0.87
685.8113403	0.09
686.6127319	0.09
687.8692627	0.07
688.7317505	0.07
713.7297363	0.06
717.6891479	0.08
719.1493530	0.02
727.3320923	0.06
728.4178467	0.06
729.4998169	0.55
730.5709839	0.49
745.5612183	0.13
746.6377563	0.20
754.9124146	0.07
755.5383911	0.08
756.6156616	0.14
762.4684448	0.06
773.4548950	100.00
774.4295044	41.19
775.0924683	0.13
787.1561890	0.16
788.5601807	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	472.1582
Annotation	Folinic acid
Peak:m/z	Relative Intensity
146.1977997	0.04
148.0510864	0.15
151.8556519	0.15
160.1847534	0.02
167.3204651	0.02
172.0229187	0.02
178.9362793	0.06
180.9416809	0.02
187.2799835	0.04
191.0416260	0.13
192.9391479	0.09
204.2944794	0.02
214.1416473	0.09
230.2815552	0.04
233.2880554	0.03
236.2117920	0.12
237.9934998	0.04
239.9579468	0.05
243.1598511	0.07
257.1522217	0.04
258.2241516	0.47
259.2414856	0.02
265.3055115	0.24
275.2887878	0.24
277.3068237	0.06
280.1277161	0.06
300.2189941	45.57
301.6024475	0.01
303.4081421	0.03
323.3856506	0.37
325.4464111	0.01
340.9599304	0.02
343.1722107	23.88
344.2326660	0.03
350.7843628	0.05
351.9666748	0.06
356.2327271	0.36
357.3596802	0.04
359.3693237	0.12
360.3857727	0.68
366.6881104	0.07
367.4186707	0.44
369.4151306	0.02
377.3172913	0.06
385.2793274	8.49
386.3917542	2.61
402.5313721	0.08
404.3003845	100.00
404.9301147	0.19
409.3997498	0.03
411.2494812	8.34
428.4558411	2.43
429.3895569	14.63
430.4850159	0.13
435.4925842	0.05
437.1989441	0.02
454.2519836	18.72
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	426.29
Annotation	Prostaglandin E2 serinol amide
Peak:m/z	Relative Intensity
122.9297028	1.56
133.0427856	5.08
135.0652466	7.52
149.1651001	2.34
155.1387177	4.95
172.8940125	2.25
182.995285	0.93
187.0505981	1.18
191.3421936	1.57
192.5035095	7.63
196.0243835	4.37
197.3528748	3.36
200.3631287	4.22
214.1313629	2.05
216.1818695	1.94
226.0725708	4.35
234.0749817	2.81
238.1619568	3.56
238.9295044	4.10
241.9834595	4.48
253.1890869	1.72
255.3877563	10.56
260.8890686	1.69
262.3754578	4.45
263.4312439	3.95
264.0851135	2.68
282.4613647	9.02
292.2161865	7.32
297.6102905	3.33
299.9245911	8.50
304.2873535	1.80
307.1448669	7.36
313.0337524	2.06
321.4098511	5.49
323.2353516	2.24
324.2085571	1.18
326.3649597	1.58
332.335083	4.75
333.1094971	1.58
335.2076416	4.74
336.1937561	2.96
339.4159241	1.93
354.0429993	8.11
355.2520447	6.76
357.362793	3.71
363.1705322	5.44
365.747467	7.89
366.4427185	0.92
367.4967041	4.87
374.4101257	3.89
377.2624817	10.82
380.112915	5.28
382.1175842	9.45
385.259613	7.13
390.0059814	2.94
392.0437317	7.38
395.394989	4.62
396.3222961	10.01
398.3818665	5.57
399.2687073	5.04
403.2323914	1.07
407.271698	1.81
408.2749023	100.00
409.0390015	8.48
411.2042236	4.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	530.0551
Annotation	Unknow
Peak:m/z	Relative Intensity
187.2761230	0.26
198.8120880	0.91
201.9671478	0.25
216.0204468	0.15
249.0235748	2.45
259.1743469	0.39
260.9820557	0.98
277.0332031	19.08
278.9845276	0.48
289.0037842	3.78
294.9876709	0.41
301.1508789	0.40
302.3304443	0.45
304.9385986	0.51
306.8757935	29.53
307.6128540	0.59
308.9898071	5.52
319.0535889	0.38
324.6099854	0.45
331.1671143	0.58
332.9122925	0.25
336.0793457	0.54
336.9345093	15.99
351.1179199	4.49
366.9408569	0.86
368.3814087	3.87
369.1184082	31.64
379.0103149	1.84
381.2040405	0.09
396.9769287	100.00
397.5884399	0.28
399.2691650	0.10
438.1046753	0.16
440.0648193	0.18
440.9603271	0.93
471.1085815	0.28
482.9879150	0.20
493.2510376	0.35
512.8132935	1.09
513.5339966	0.70
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	241.092
Annotation	1D-1-Guanidino-3-amino-1,3-dideoxy-scyllo-inositol
Peak:m/z	Relative Intensity
109.0156708	0.26
123.1211395	0.03
131.0813446	1.27
137.0141449	0.12
149.1624298	0.07
155.0747833	0.05
155.9359283	0.18
157.0667572	0.02
169.0083160	0.08
173.0617828	100.00
181.2154388	0.02
182.2319489	0.03
195.1241302	0.41
196.8354950	0.10
199.1004791	0.95
211.0103149	0.03
213.9604950	0.07
217.2235718	0.10
223.2949829	0.26
224.1851349	1.26
240.9511566	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	650.2126
Annotation	Unknow
Peak:m/z	Relative Intensity
220.7821808	0.06
222.1928711	0.01
249.2604065	0.02
259.3718567	0.02
262.8318176	0.05
323.1760864	0.41
324.0766602	0.01
329.1520996	0.03
341.1715698	0.04
346.3539429	0.01
383.3704224	0.03
412.5312500	0.02
429.2470093	0.01
438.9505005	0.01
443.0343628	0.03
448.3974609	0.02
475.5554810	0.05
503.2815552	100.00
504.3753662	5.81
510.3071899	0.02
513.2853394	0.02
551.4935913	0.01
560.1699829	0.01
561.3216553	0.02
631.3379517	0.04
632.4413452	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	665.1815
Annotation	Unknow
Peak:m/z	Relative Intensity
203.1878815	0.06
284.1115112	0.07
285.1149292	0.23
317.3059082	0.20
329.2271423	0.04
330.2097778	1.30
347.2208252	0.05
423.3328247	0.08
431.3549805	0.08
444.2520142	0.08
460.3755493	7.65
461.2457275	100.00
462.1253052	0.29
463.3709106	0.59
472.2377319	0.06
486.2903442	0.06
489.4612427	0.06
548.4762573	0.04
549.3025513	0.06
560.2634888	0.29
576.6004028	0.09
618.6415405	0.18
619.6275024	0.03
620.8720093	0.54
623.5523071	0.17
629.5745239	0.09
633.8537598	0.20
635.5132446	0.05
641.6139526	0.14
647.1055298	0.82
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	373.13
Annotation	2,3-Dehydrokievitone hydrate
Peak:m/z	Relative Intensity
147.9150238	0.98
162.6769714	1.29
178.8649902	1.96
193.1032257	4.06
194.1769867	3.14
201.1974335	2.48
207.0667419	1.80
210.9923553	0.79
219.0202332	33.76
221.9016418	5.87
246.7101135	1.19
247.34375	2.41
249.1206665	2.16
299.4139709	7.25
304.8132935	5.49
319.32901	4.27
325.3508911	7.54
327.1834106	2.63
337.1016235	4.67
343.085022	100.00
355.1170349	87.96
357.5245972	2.22
363.7398376	3.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	365.0514
Annotation	Phosphoribosyl-formamido-carboxamide
Peak:m/z	Relative Intensity
119.1831589	0.03
134.1481018	0.23
135.0303650	1.33
135.6936188	0.02
140.9266357	2.45
160.8175507	0.02
167.3794403	0.02
179.0862579	17.71
184.9763489	30.82
186.0915375	0.06
203.0226746	100.00
212.2267761	0.06
217.3353271	0.09
219.2537537	0.12
221.0034180	0.04
228.8942871	0.04
235.4252319	0.03
247.1671143	0.07
248.7649536	0.03
259.0448914	0.10
264.2771301	0.05
267.2227783	0.03
271.1176147	0.07
275.3545532	0.02
289.5233154	0.03
290.4826050	0.03
293.4607239	0.12
304.1964722	0.09
305.2615967	0.17
310.2630005	0.03
317.4381714	0.03
318.4944763	0.07
319.2709351	0.11
320.3302917	0.09
321.4893188	0.05
323.0751038	0.11
327.1474304	0.02
329.1770020	0.03
335.1622925	0.21
336.2147217	0.03
342.0775452	0.03
343.1847229	0.06
346.0826111	0.03
347.1639404	0.49
349.5055237	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	546.1227
Annotation	Unknow
Peak:m/z	Relative Intensity
163.1754456	0.30
168.9998779	3.18
217.1295776	1.59
259.0957642	0.29
261.3498840	0.44
267.3897400	0.46
287.1884766	0.54
292.4570312	0.38
304.1298828	0.46
312.7991333	1.82
324.4863892	0.36
349.0844116	100.00
359.3192749	0.39
366.2435303	0.27
383.3093262	0.50
384.1483765	0.45
397.3452759	0.38
402.5898438	0.60
406.6099243	0.48
491.5930786	0.54
510.9611816	0.99
527.2894897	1.13
528.1528320	0.36
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	523.2381
Annotation	Unknow
Peak:m/z	Relative Intensity
155.2241211	0.58
163.0776825	2.86
179.1841583	0.37
191.1114502	0.14
193.8995209	0.07
199.1377258	5.22
212.8803253	0.12
234.7957306	1.11
241.2520447	1.04
249.1028442	0.07
252.8099976	0.15
264.9740295	1.90
269.1220093	0.42
270.5469971	1.17
271.3809814	0.39
283.2894897	0.22
299.2289429	0.18
299.9539795	0.34
301.1887207	3.70
324.9911499	1.55
331.0363770	0.05
341.4072876	0.06
343.1350098	0.48
347.3619995	0.18
351.3244019	0.26
358.9856567	0.33
360.1547852	0.44
361.3580933	100.00
399.4840698	0.21
402.2302856	0.10
403.3626709	0.53
428.4758301	0.13
433.2967529	0.07
436.3967285	0.08
449.3196411	0.08
477.2921753	62.62
477.9308472	0.35
479.3430176	0.47
480.2821655	0.29
481.5003052	0.27
484.9900513	0.12
487.3958130	0.13
488.1821899	0.08
493.4761353	0.19
504.0598145	0.18
505.2066040	0.05
506.2437744	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	500.77
Annotation	Unknow
Peak:m/z	Relative Intensity
280.9993591	3.62
326.1265564	0.80
327.0703125	1.97
346.3909302	1.50
347.2961121	0.58
348.8814392	31.61
364.1552124	8.61
364.9367065	84.64
374.6074829	1.00
402.4067078	1.07
411.3321838	0.97
416.8812561	100.00
432.8403320	98.09
482.2321167	5.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	293.1451
Annotation	Unknow
Peak:m/z	Relative Intensity
100.7790680	0.38
109.9227829	0.13
129.9573975	3.74
133.1605835	0.06
143.2216187	0.08
147.0259247	100.00
149.0909729	0.17
203.1869507	0.21
263.3116150	0.10
275.1766968	1.46
276.0645447	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	384.09
Annotation	Phosphoribosyl-formamido-carboxamide
Peak:m/z	Relative Intensity
142.9058228	0.57
163.0155334	7.39
168.0490570	0.52
181.0387421	100.00
194.5100098	0.60
197.5373535	0.93
201.1131134	0.21
203.9158020	0.37
228.1268005	0.46
229.9912109	0.79
245.9466248	0.70
253.0855408	0.62
254.5760193	2.18
256.9184875	0.70
262.3453064	1.97
284.3359985	0.70
287.7762756	0.55
290.4694214	0.59
291.3004456	0.77
294.9730225	1.69
309.3976135	1.27
323.2918701	2.68
323.9943542	0.96
325.8311157	3.30
337.4714966	0.62
339.4225769	0.63
343.1756592	0.44
346.9275513	1.00
349.0496216	0.34
353.3672485	1.89
365.0692139	4.93
366.5550842	45.21
367.5385132	1.92
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	377.09
Annotation	Lactulose
Peak:m/z	Relative Intensity
133.0711670	0.07
160.8987732	0.04
178.4919739	0.21
179.1185303	0.45
196.9263916	0.68
203.1889648	0.08
209.1871338	0.05
215.1017609	8.00
226.3134766	0.02
248.7593384	0.08
287.4301453	0.02
332.3764954	0.11
333.0847168	0.05
341.1827087	100.00
342.1119385	0.10
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
68.8956451	0.28
70.9643097	0.91
72.8156128	0.03
82.8582459	1.07
84.9834442	10.79
85.9664307	0.22
86.9851379	13.48
88.9420166	1.22
97.0573883	3.24
98.9732819	4.77
101.0393829	0.58
106.6630402	0.02
110.9487915	12.20
113.0294495	0.49
114.9588318	3.73
119.3231049	0.07
129.0339050	100.00
131.0326691	0.18
133.0422211	0.22
137.0984344	0.03
141.0135651	9.21
143.0541840	0.33
144.4300995	0.05
145.0330658	0.22
147.0376740	0.08
148.7946777	0.05
158.9769897	46.12
163.1608276	0.09
165.0828705	0.93
173.0967255	0.10
177.1637878	0.72
190.9837341	2.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	746.69
Annotation	Unknow
Peak:m/z	Relative Intensity
292.7200317	0.83
342.7306824	1.44
358.7675171	3.48
410.7708130	0.30
426.6722412	4.23
440.7300415	0.27
443.0335083	0.70
472.0288696	0.43
494.7374878	11.19
510.5736084	25.55
524.5147705	1.39
526.6183472	8.64
571.9024048	0.33
578.7128296	24.03
580.9979858	0.76
594.6344604	32.31
610.4071655	1.33
617.0432739	0.41
640.7101440	1.81
662.5930786	100.00
678.4830933	3.91
683.0145264	1.14
700.2096558	1.77
700.9702759	8.58
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
159.0064392	0.47
160.0989380	0.16
161.3385620	0.01
198.1464386	0.04
229.1348572	0.11
230.0852356	0.01
247.1639404	0.03
271.5623779	0.04
273.0435486	100.00
273.9968872	27.35
311.8477783	0.04
313.2192383	0.01
313.8578796	0.01
316.0547791	0.01
331.0295410	0.01
341.0581360	0.28
343.9076843	0.02
359.3546143	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	220.12
Annotation	cis-Zeatin
Peak:m/z	Relative Intensity
68.94154358	0.19
71.97775269	1.57
85.07060242	0.24
87.15917969	0.21
89.89367676	25.24
94.92785645	0.33
98.13829041	0.16
115.9473419	2.79
156.2603912	0.37
160.214859	0.13
162.0728302	0.31
164.1595306	0.13
166.0106506	0.72
172.120285	0.31
174.1251068	4.91
178.7389069	0.63
180.6264343	0.29
184.0789948	22.13
190.0853729	0.75
192.0841217	4.20
202.1016083	100.00
203.0100555	0.14
211.1334076	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	523.2298
Annotation	Unknow
Peak:m/z	Relative Intensity
155.1368713	0.97
162.9640198	0.51
168.9282227	0.03
175.1423798	0.05
177.0614624	0.03
179.3075409	0.03
183.1427002	0.02
193.1363678	0.05
199.0797424	9.57
202.9806366	0.04
213.0759888	0.08
234.1150665	0.05
234.8566132	0.11
236.9609528	0.04
238.1268463	0.06
241.2140656	1.12
247.0565796	0.04
250.8890076	0.15
253.1853180	0.35
263.2131958	0.05
264.4260254	0.27
265.0694885	0.32
269.3642578	0.06
270.9070435	1.32
276.8973999	0.04
279.3295898	0.15
295.0328369	0.04
299.1237793	0.04
301.2235718	4.48
306.2456665	0.03
307.3063965	0.11
317.2089844	0.10
320.0689087	0.05
325.1012573	0.56
328.5295410	0.12
331.2148438	0.20
333.4331665	0.24
343.3109131	0.21
347.6185913	0.08
348.3295288	0.02
359.0996704	0.04
361.3244019	100.00
372.1979370	0.02
391.5462646	0.06
397.9671021	0.03
403.3877563	0.25
407.2768555	0.03
422.4439087	0.02
427.1541748	0.03
435.5671387	0.10
437.2092896	0.11
443.3937378	0.05
463.5729980	0.09
477.3165894	11.25
479.1312866	0.43
487.3258667	0.02
503.3320923	0.05
504.6530151	0.26
505.5359497	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	584.73
Annotation	Unknow
Peak:m/z	Relative Intensity
203.7316589	0.07
212.9246521	0.28
215.9819183	0.08
235.2282410	0.34
274.9840698	0.48
291.0989990	0.59
332.8847046	0.11
336.2035522	0.15
348.8841553	1.30
358.9710693	0.22
364.9152222	3.13
372.0970459	0.18
380.5291748	0.22
389.3197021	0.14
408.1708984	0.16
416.9588013	1.70
430.5634766	0.10
432.7532959	18.02
448.7860718	11.44
498.7744141	0.47
500.6943970	100.00
501.3478394	0.77
516.1238403	2.56
516.7559204	28.88
517.5241699	0.09
538.0032349	2.38
541.1958618	0.15
541.9539185	0.17
543.1129761	0.07
561.2335815	0.39
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	668.69
Annotation	Unknow
Peak:m/z	Relative Intensity
206.6842346	0.15
364.8545532	0.17
369.5021362	0.38
386.1157227	0.22
416.6911011	0.90
423.0842285	0.30
449.0450439	0.38
465.1530762	0.27
466.1771240	0.42
499.0042725	0.21
500.8973389	2.12
502.8609619	0.26
504.2048950	0.39
506.2579956	0.46
512.9984131	3.24
516.7493286	11.17
521.9686890	0.42
530.8635254	0.52
532.0064087	0.66
532.9706421	0.51
556.1814575	0.20
569.8138428	0.27
582.5385132	0.32
584.6444092	100.00
585.2825317	0.91
600.6570435	14.38
603.1592407	0.42
621.8649292	7.72
624.9967651	0.26
626.7078247	1.29
645.3922119	0.17
646.0248413	0.35
651.5216064	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	615.1866
Annotation	trans-delta-Viniferin 3''-glucoside
Peak:m/z	Relative Intensity
176.4998322	0.09
177.1332245	0.06
182.0268402	0.12
197.0478058	0.07
223.9819641	0.09
239.1518250	0.37
240.0488586	0.05
255.1020203	0.09
257.0826721	0.05
271.2069092	0.60
272.9501953	0.20
282.1444092	0.04
285.2733154	2.41
297.3621521	0.15
299.0069580	0.44
314.1795654	0.11
315.1568604	3.03
325.3135376	0.44
351.6623535	0.07
353.1261597	0.51
403.3502808	0.16
418.0144043	0.09
435.0695190	0.11
447.2958984	0.21
453.1660156	0.13
459.3602295	0.61
472.2486572	0.08
476.9190674	0.07
477.5525513	0.70
485.3752441	0.12
491.4404907	0.23
493.3260498	0.20
495.2956543	100.00
524.2380371	0.13
558.3056641	0.09
567.5627441	0.19
571.4700317	4.96
596.3308716	0.07
597.5710449	0.34
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	266.02
Annotation	Unknow
Peak:m/z	Relative Intensity
191.3409424	0.04
217.2603912	0.09
222.1441650	0.08
224.1135101	15.10
225.0352631	100.00
229.4689331	0.27
236.3930817	0.03
237.9187622	0.02
241.7062988	2.19
242.8406219	18.43
250.4698486	0.04
260.8019104	0.02
264.7229004	0.05
266.0531616	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	342.82
Annotation	Unknow
Peak:m/z	Relative Intensity
122.5773926	0.57
156.0990601	0.24
175.2983856	0.32
190.8186493	2.70
206.8110046	5.22
258.8488159	100.00
274.8135376	86.05
296.8250732	35.30
324.2734070	2.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	784.0471
Annotation	Unknow
Peak:m/z	Relative Intensity
234.0769958	1.27
272.2389832	0.68
285.2750244	0.48
286.4246521	0.87
290.0999146	0.26
303.2305908	0.38
321.0558472	2.78
341.9938660	0.14
369.3868408	0.16
370.8099365	0.20
387.4874878	0.66
399.8297729	0.29
404.4827271	0.78
405.2853394	0.61
406.6322632	0.88
422.2201538	5.97
423.3002319	1.22
431.3933105	0.94
462.5760498	2.29
496.9186401	0.73
503.2272339	0.62
505.3808594	0.32
519.0591431	1.70
521.4003906	1.51
540.2260742	0.76
546.1813965	0.31
553.2374878	1.09
557.4741821	0.27
561.9716187	2.20
568.7031860	0.53
584.6202393	0.40
590.3959351	0.34
610.3757935	0.35
611.5065918	0.76
619.2288208	3.40
620.1542358	1.18
632.4341431	0.45
633.3004761	0.52
638.1542358	0.98
644.0640869	0.45
648.1199951	0.17
666.2608032	1.08
668.5106812	2.05
669.5361328	0.41
670.3615112	0.30
672.0503540	0.37
672.7415161	2.07
673.5975342	1.54
677.9015503	6.30
683.5565186	0.73
684.2442017	1.30
688.9765015	0.91
691.4593506	0.21
692.7525635	5.46
693.5211792	1.68
694.4050903	3.84
695.0310669	1.33
697.8186646	1.02
701.2116089	2.03
717.4755249	0.98
719.4636841	3.20
720.7152710	1.24
722.3428345	3.96
723.1846313	6.29
725.3516235	1.87
728.4999390	14.68
729.2427368	8.02
731.0121460	1.62
731.9961548	2.31
734.2981567	13.39
734.9871216	6.66
735.6713257	1.45
736.6829224	0.52
740.7593384	1.97
741.4466553	1.91
745.3240356	0.83
750.3892212	2.02
752.5950928	0.27
758.5554199	0.61
761.9767456	1.39
762.8136597	1.14
763.9602661	1.55
766.1013794	4.61
766.8407593	10.80
767.6135254	2.74
769.3672485	0.75
772.5399170	100.00
773.6965942	5.15
778.4872437	0.16
779.2619629	0.30
796.8116455	0.50
803.5952759	0.68
812.4078369	1.26
813.3411255	0.56
821.7728882	0.73
833.0712280	1.20
834.3088989	1.23
836.4597778	0.51
842.3173218	15.48
843.2983398	4.65
844.5011597	0.74
853.4425049	1.37
854.5827637	1.72
907.5165405	5.89
916.0344849	7.43
916.7306519	4.25
917.3817749	1.01
923.0216675	1.39
947.7294312	1.01
948.8618164	0.19
956.2055664	1.72
957.5167847	2.70
959.6033325	0.38
963.4254761	0.34
965.3522339	48.94
966.1735229	19.65
966.8822632	5.20
967.8002930	1.79
969.3576660	0.99
974.8871460	0.77
978.6942749	0.99
990.6694946	0.70
993.5494995	1.65
995.8424683	1.05
998.5920410	0.67
999.9042969	1.52
1007.0297240	7.88
1008.1194460	3.65
1015.8890990	38.88
1016.8294070	10.74
1017.8724980	2.48
1019.2019650	0.21
1033.4260250	0.68
1036.1892090	0.22
1036.9421390	1.71
1042.3792720	1.16
1042.9975590	0.72
1050.1135250	3.44
1050.7431640	7.07
1051.6855470	1.85
1055.2872310	1.13
1056.4705810	0.40
1059.6091310	17.82
1060.7667240	0.75
1061.8992920	0.95
1101.1533200	6.26
1102.0496830	7.02
1104.2750240	0.72
1109.9896240	23.21
1110.9616700	8.84
1114.5195310	1.70
1115.7753910	1.33
1116.5302730	1.06
1124.7318120	0.78
1195.0942380	0.75
1198.4492190	0.59
1201.7351070	0.19
1228.7202150	0.35
1341.5495610	1.18
1342.6744380	1.54
1366.9677730	0.90
1390.7304690	0.22
1489.5327150	0.27
1491.8431400	0.33
1596.4445800	0.17
1609.7318120	0.26
1624.9862060	0.39
1634.7424320	10.09
1661.9854740	0.15
1715.5462650	0.24
1717.1652830	0.75
1737.8822020	0.26
1741.4625240	0.43
1745.2611080	0.30
1748.2316890	0.17
1750.4490970	3.46
1751.0682370	0.68
1752.0677490	0.32
1766.7882080	1.10
1771.7530520	0.19
1775.3854980	0.16
1786.5838620	0.33
1787.9997560	1.16
1790.7712400	0.62
1806.7028810	0.97
1808.0837400	0.19
1812.4348140	0.19
1815.7741700	0.44
1817.8103030	0.37
1822.9591060	0.89
1824.1873780	1.19
1826.0334470	0.29
1832.5272220	0.14
1839.9079590	0.16
1841.0490720	0.64
1842.2093510	0.17
1855.3513180	0.14
1856.7156980	1.24
1859.8092040	0.22
1860.8450930	0.19
1861.7238770	0.50
1862.3542480	0.35
1863.1672360	0.38
1865.1024170	6.54
1869.4500730	1.60
1875.8546140	0.19
1876.6281740	0.19
1881.4665530	2.23
1885.9284670	7.80
1890.5401610	1.47
1894.0489500	9.66
1896.8845210	3.80
1899.1071780	0.27
1899.9603270	0.19
1902.5334470	0.27
1903.2352290	0.39
1905.4202880	0.19
1906.0325930	3.38
1907.0269780	0.19
1909.6408690	0.27
1910.8538820	1.97
1912.7017820	3.40
1913.4183350	5.14
1916.3360600	1.69
1920.0291750	0.56
1921.0861820	0.16
1922.3895260	0.23
1923.3065190	0.56
1925.5841060	0.22
1928.2545170	0.74
1929.1024170	0.16
1930.2833250	38.84
1933.2135010	0.99
1933.9191890	2.19
1936.1368410	1.28
1937.1467290	0.73
1938.5577390	0.60
1939.9239500	0.58
1940.9715580	0.86
1945.3947750	2.03
1946.0208740	8.06
1947.3107910	2.64
1947.9265140	52.69
1948.6678470	5.75
1949.4051510	0.27
1950.3607180	0.13
1952.5393070	0.52
1954.1512450	0.27
1955.4686280	0.85
1958.6859130	1.47
1960.6330570	5.04
1961.6437990	0.27
1962.9276120	0.36
1963.9558110	0.17
1965.0711670	9.34
1966.3817140	0.59
1967.4530030	0.73
1969.9154050	1.61
1971.2232670	3.25
1972.3195800	0.22
1973.7307130	1.79
1975.9420170	5.04
1976.6851810	0.81
1977.4890140	4.25
1978.1473390	5.92
1979.6149900	1.30
1980.2178960	8.76
1983.0714110	12.32
1983.7926030	0.78
1984.6182860	1.10
1985.2913820	0.77
1986.1412350	2.82
1986.9615480	0.13
1987.6524660	1.17
1988.5197750	1.62
1989.4156490	9.55
1990.9177250	2.20
1991.7171630	0.95
1992.3187260	3.43
1993.8563230	2.40
1995.0140380	27.80
1997.7360840	2.48
1998.6195070	0.96
1999.4890140	7.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	482.7627
Annotation	Unknow
Peak:m/z	Relative Intensity
147.0126495	6.30
174.9037476	0.41
205.1435547	0.65
227.8706818	1.36
234.8239288	1.20
245.2633209	0.70
260.3417664	1.84
292.5658569	1.16
296.5769043	0.93
313.2253418	1.60
313.9786377	1.71
321.1020203	0.96
325.0026245	0.63
335.5537109	0.47
341.0738525	13.38
342.0903015	2.78
353.6103210	0.72
373.9254150	0.36
375.0614014	0.22
379.3376160	0.44
393.3959351	0.41
394.1445312	0.34
396.0830383	5.64
402.5092468	0.74
409.5770569	4.11
410.2316589	2.31
418.8413391	3.30
426.3409119	1.14
426.9684448	2.90
429.3900452	1.36
437.1800232	1.26
439.0547791	3.41
445.2108459	0.48
450.2619324	0.59
454.2651062	2.81
455.3189392	1.36
460.3489075	1.46
464.2583923	0.22
465.0533142	2.23
466.1440735	1.13
474.1294250	8.65
475.1036072	3.05
477.2944031	0.33
511.4955444	4.91
512.6406860	0.29
564.5270386	0.98
575.5584717	0.64
591.4682617	2.04
606.4061279	1.12
607.3110352	2.96
624.4608154	16.72
625.3986206	4.95
634.8560181	0.22
665.6997070	0.32
700.1558228	0.40
704.9869995	1.03
705.6717529	6.24
706.5684814	1.51
736.5167847	0.31
737.7117310	1.20
739.0206909	1.66
801.6597290	0.84
818.5770874	100.00
819.4873657	33.47
820.1082153	0.92
934.5202637	0.49
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	609.2181
Annotation	Unknow
Peak:m/z	Relative Intensity
199.3695221	0.05
283.4082947	0.04
313.2493896	0.04
320.1611328	0.16
324.5406494	0.09
346.4343872	0.03
359.2022095	0.02
361.3405151	10.03
381.6613770	0.06
383.2088013	0.06
385.4494629	0.03
389.3604126	0.04
403.1947021	0.13
404.8022461	0.13
407.4824829	0.10
429.0692139	0.04
435.4522705	0.17
461.4329834	0.02
463.7621460	0.02
505.2180786	0.11
515.6783447	0.04
521.2482910	0.16
522.3947144	0.18
523.5466309	0.03
529.3079224	0.02
530.5773315	0.14
533.2133179	0.14
534.0558472	0.12
545.2067261	0.09
547.3059692	0.04
548.4899292	0.03
562.4835815	0.09
563.2430420	0.23
565.2860718	100.00
570.4073486	0.03
573.7004395	0.03
579.6253052	0.12
581.6784668	0.08
587.0604248	0.12
587.6715088	0.11
591.1234131	0.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	391.2834
Annotation	Di(ethylhexyl) phthalate
Peak:m/z	Relative Intensity
121.2062073	1.03
123.0177765	7.43
132.0766907	4.28
140.8285828	3.06
143.0190582	1.40
149.0187531	100.00
149.9669952	45.83
151.2153931	1.76
155.1794128	3.58
161.0719604	1.61
163.013916	1.03
167.1820374	38.59
168.0374146	2.92
170.9460754	2.13
175.1416626	1.06
177.1925354	6.16
178.9283142	2.13
181.1189728	1.49
183.0771179	7.63
185.0392761	5.69
187.0701599	1.77
192.9151001	1.85
195.2584229	1.28
197.0748291	3.26
198.6854858	1.84
205.209198	2.03
210.9519653	1.94
212.112381	2.75
214.5827179	2.86
223.0890198	1.30
230.9336548	1.12
233.174469	2.48
242.2194824	2.37
247.1290894	1.39
249.2852478	1.39
254.8005981	7.69
258.3719482	1.39
260.2005615	13.21
260.935791	12.71
261.6483459	3.05
272.7565308	0.75
279.0129395	21.30
280.0914612	23.61
287.118103	1.58
299.0692139	0.97
301.94104	12.19
307.043396	2.76
311.5350647	0.94
318.1843262	2.65
325.1004028	6.12
328.9403687	3.21
330.4611816	0.94
331.1234436	4.20
332.2055054	2.01
333.7644958	2.40
338.3320923	2.74
340.7536621	3.43
342.4857483	1.61
343.3996582	4.88
346.062561	1.72
351.1067505	3.69
356.9319763	40.42
365.2108459	1.05
374.1531372	8.34
374.9997864	21.71
380.1133728	2.93
382.8648071	3.53
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	454.79
Annotation	Unknow
Peak:m/z	Relative Intensity
200.2331390	0.11
242.1961517	0.02
258.8764954	0.03
260.7402649	0.36
275.2128601	0.05
277.1898804	0.28
279.0323486	0.26
280.9437561	0.49
286.9609680	6.28
293.0824585	1.12
294.9779053	0.04
296.8448486	0.19
303.1490479	0.24
319.2589722	0.35
333.1797180	0.85
334.2691040	0.59
335.2414551	0.65
362.4243774	0.03
368.1372070	0.05
369.1188965	0.35
370.8575745	100.00
386.6079407	0.79
387.2597961	0.14
394.8929749	0.72
409.0645447	0.05
436.7751160	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	429.0752
Annotation	Unknow
Peak:m/z	Relative Intensity
165.2599945	0.14
171.9773254	0.05
198.1418457	0.22
203.1978302	0.09
218.0803833	0.04
220.0787659	1.38
237.9208374	0.17
239.1109619	0.09
241.9525452	0.08
264.0967407	7.90
265.0788879	0.19
266.2883301	0.05
282.3630981	0.07
291.0778198	0.35
308.2393799	0.19
323.3678589	0.07
340.9280090	0.22
343.4448242	0.44
351.3276672	0.07
356.3198242	0.25
365.1860046	0.10
366.2580566	0.25
371.4706726	0.10
381.1271973	0.21
383.1211548	100.00
383.9983521	1.69
385.2390442	16.48
391.0004272	0.16
400.6460876	7.48
401.2557373	3.31
410.4512024	0.05
411.4239197	0.14
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
95.0867691	2.19
99.01873016	0.44
100.8957062	0.78
107.1571045	0.24
117.0144653	0.48
129.0253296	1.70
139.2745361	0.72
143.163208	2.73
145.9639893	0.68
149.1701965	2.06
151.1392822	1.19
152.9927368	3.46
154.7823181	1.52
171.10672	2.38
173.0012665	1.82
177.2459869	0.51
179.1231079	1.23
180.9017487	0.73
182.9743652	3.66
185.2756042	0.83
193.4344788	0.48
195.0921631	1.27
197.1779175	1.60
198.2277069	2.30
206.5371094	1.13
207.3574219	0.44
209.0050964	5.71
211.0759277	1.60
212.2003479	1.70
216.0154114	0.79
221.2908325	0.44
223.0322266	0.96
227.0678406	1.08
235.0920715	1.06
237.3044434	1.37
239.3005371	0.96
241.2648926	4.03
251.0480957	0.54
253.0678711	6.47
255.5116882	1.06
264.6092224	0.75
265.3340149	0.61
266.4534912	1.61
269.2877808	0.41
275.2430115	23.32
280.3430176	1.54
283.2802124	1.37
293.209137	100.00
294.4031982	1.36
302.2388916	1.96
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1117.541
Annotation	Sandrosaponin IX
Peak:m/z	Relative Intensity
439.6867676	0.08
453.6201477	0.11
454.5712280	0.08
455.5162964	0.08
456.6283569	0.18
481.2775879	0.08
498.6764526	0.04
500.1819763	0.03
523.5036621	5.53
524.5653687	7.40
525.4764404	0.31
537.4964600	0.02
538.5982666	0.15
546.8020020	0.02
551.7891846	0.20
552.7601318	0.13
566.7978516	0.07
569.6015625	0.11
570.7246094	0.78
571.5861816	0.04
587.5225830	0.01
588.6483154	0.05
589.5095215	0.02
595.4211426	1.00
596.4565430	1.50
597.2896729	0.09
613.5397339	0.47
614.6121826	0.82
622.4732666	0.03
632.6892090	0.07
696.8049316	0.02
714.7196655	0.23
715.9731445	0.04
731.5859375	0.33
732.6317139	1.05
733.6197510	0.08
750.7509155	0.13
757.7112427	0.63
758.6260376	1.34
759.7406006	0.12
775.9716797	0.08
776.7246094	0.37
777.7354736	0.06
793.6995850	0.28
794.5714722	0.29
795.4189453	0.06
893.7855225	0.44
894.7156982	1.36
895.7591553	0.04
912.7565918	0.14
937.7016602	1.50
938.6860352	5.58
939.6304932	0.23
942.0434570	0.08
955.7436523	20.19
956.6810303	100.00
957.7452393	5.80
997.3159180	0.06
998.3205566	0.07
999.0727539	0.07
1027.3870850	0.01
1028.7287600	0.03
1038.6893310	0.03
1058.6213380	0.07
1059.6038820	0.04
1100.6813960	3.64
1101.7177730	0.27
1102.3807370	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	281.25
Annotation	Linoleic acid
Peak:m/z	Relative Intensity
81.22022247	0.99
84.95233154	0.48
94.95103455	3.15
96.94693756	4.65
98.71951294	0.53
101.9824524	0.70
108.8880157	6.12
121.0809708	2.20
123.14785	0.55
124.8804016	3.78
126.8687744	0.64
132.9737854	6.03
135.1400146	2.93
136.9899292	2.82
139.0385132	3.35
141.1103516	3.72
147.0578003	5.88
149.0822754	3.47
149.9570312	0.48
151.2173767	7.24
153.1645966	4.11
155.0569458	4.00
157.1752625	3.61
161.170166	2.11
163.1733551	3.72
165.1974182	1.32
166.9464111	0.54
169.004715	4.27
171.0709991	3.90
175.1092529	8.90
179.0542145	5.79
183.0202026	19.55
185.0167542	4.18
186.9188843	1.89
189.2833862	4.47
190.9612122	2.59
197.2840881	1.80
199.1472168	2.57
201.0344543	0.86
203.205719	2.91
205.1276245	13.95
206.1378479	1.88
207.2823792	1.90
210.9595642	1.94
217.2552795	6.27
218.4781494	1.99
221.2020874	2.66
221.9761353	1.04
223.235199	14.93
225.3244629	1.60
230.2034302	0.83
234.802948	1.61
235.43927	3.56
237.2767639	0.64
239.3316956	33.14
245.2261353	87.35
250.20224	3.17
253.2364502	1.92
263.2436523	100.00
264.1536865	1.40
272.2449341	3.78
281.3940735	1.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1088
Annotation	fagopyritol A1
Peak:m/z	Relative Intensity
100.9293213	4.00
107.8265152	5.45
113.0244064	5.33
113.8463135	2.62
118.8691711	3.71
120.129097	1.60
125.0722046	1.71
126.0455246	4.18
129.1004944	1.98
130.9667053	5.93
142.9620361	20.75
144.0146179	7.15
149.0413208	1.29
154.1128235	2.24
161.0366516	21.65
161.8825378	7.60
164.1993713	1.29
167.2249603	1.60
177.0393677	1.71
179.0514984	100.00
180.1069336	24.23
192.2755432	3.89
212.1582642	4.48
218.2236633	5.85
227.1584167	5.98
257.0708008	1.82
257.81073	2.65
282.0420532	4.24
295.0731812	1.38
295.9486694	1.50
297.105011	4.51
299.3233948	0.87
328.2665405	0.97
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	683.2255
Annotation	Lactulose
Peak:m/z	Relative Intensity
339.3735962	1.26
341.1724243	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	426.29
Annotation	Prostaglandin E2 serinol amide
Peak:m/z	Relative Intensity
129.0238495	1.83
133.2930908	2.72
145.2089996	1.28
161.0288086	1.97
168.9276581	1.15
173.1325989	1.75
184.9803467	5.11
194.1794739	1.70
201.5224609	7.44
213.1425629	3.49
221.1895447	5.84
225.2150269	1.28
233.0545197	3.55
239.3565674	12.06
241.0476074	2.17
250.2398376	2.66
253.2702026	3.72
257.265564	4.79
260.2238464	4.96
264.3699341	3.42
268.8729248	2.52
273.2005615	7.73
280.813385	4.07
282.5139465	3.44
289.9030151	2.53
292.357605	5.12
296.1666565	9.50
307.5601196	1.76
308.2715454	2.80
314.2285767	2.80
322.3145752	3.46
326.2396545	9.41
338.2984314	3.14
342.9078369	5.87
344.3783264	4.24
349.1948853	2.53
353.2426758	16.25
354.0810242	6.23
359.2024841	1.97
359.8684692	7.73
363.1850891	5.66
366.2285461	20.16
367.1671448	4.11
367.9529419	1.56
369.315155	2.97
372.6481018	2.86
377.4793091	18.65
379.9883728	4.60
381.7845764	8.32
384.2745056	2.60
385.2027588	7.86
390.5019226	10.31
392.6539612	2.39
395.4311829	9.54
396.1250305	5.42
399.4554749	1.83
408.2784424	100.00
409.1219482	8.73
411.3164978	8.68
417.2588196	3.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	358.83
Annotation	Unknow
Peak:m/z	Relative Intensity
123.1505737	0.26
164.7275085	0.49
180.9049377	2.70
191.0035706	1.06
207.0400696	4.52
212.8841705	1.47
223.1645508	0.94
274.8713379	100.00
290.8113403	29.25
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
97.16752625	1.30
109.1846619	4.47
116.9184265	1.09
120.7473297	0.59
131.1703186	0.72
134.8735962	1.86
137.043808	0.87
139.1964417	1.40
142.920929	0.92
145.2692871	1.77
146.9078674	0.45
149.0303345	2.20
153.1120911	0.61
155.0682983	1.02
157.1219788	1.07
161.112854	0.75
163.1199188	1.06
168.9381409	1.91
169.9755859	0.49
172.7738495	2.76
181.7142639	0.61
183.205658	0.98
195.126709	1.55
196.8342438	1.00
206.340271	0.37
209.16922	3.85
211.0374146	1.97
213.10672	2.40
218.1162109	1.78
219.3330688	0.37
223.2887878	1.65
225.1253357	0.81
237.3577881	1.65
239.1108704	5.74
241.2799683	3.14
243.497406	0.65
251.2146301	5.04
253.0184937	9.02
257.179657	3.02
265.3189392	0.92
268.2286072	0.40
275.3334045	8.11
276.8861389	0.49
283.2825928	6.52
289.7825928	1.40
293.2056885	100.00
293.8355713	0.25
301.7174377	2.22
312.4622803	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	182.0807
Annotation	4,6,7-Trihydroxy-1,2,3,4-tetrahydroisoquinoline
Peak:m/z	Relative Intensity
135.9839935	20.97
139.2279053	0.06
141.0319366	0.03
146.9428864	0.23
164.9516754	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	377.09
Annotation	Unknow
Peak:m/z	Relative Intensity
113.1053238	0.06
143.0173950	0.06
159.0606689	0.03
161.2067108	0.06
179.0131073	0.75
196.9114380	0.39
215.1062012	7.00
341.2481689	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	526.76
Annotation	Unknow
Peak:m/z	Relative Intensity
190.9316406	0.35
274.5275269	1.24
275.2349854	0.45
290.8377075	8.39
325.6983643	0.28
358.8054199	8.00
374.7624512	3.31
420.7968750	3.66
442.7316895	100.00
458.7919922	5.93
459.4273682	0.10
466.9049683	1.77
480.6430054	6.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	353.0876
Annotation	ST077074
Peak:m/z	Relative Intensity
109.0272522	0.05
111.0414581	0.07
127.0627975	0.05
133.0169525	0.04
134.0641174	0.06
135.1349335	1.01
136.2008972	0.13
143.184906	0.07
155.8262024	0.03
161.0081482	0.47
162.1364288	0.10
173.1179199	2.57
174.1513824	0.16
179.0467224	6.67
180.1074524	1.12
189.0527802	0.01
191.0358124	100.00
192.1421967	12.63
220.9616089	0.01
245.3808594	0.01
292.281189	0.03
306.9822388	0.03
308.0606079	0.02
309.2987671	0.12
335.3361511	0.15
336.1856384	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	646.76
Annotation	Unknow
Peak:m/z	Relative Intensity
190.8220825	0.33
206.7863312	0.21
223.6933289	1.02
251.1982727	0.60
259.0446472	0.13
275.0061646	1.21
323.4921875	0.09
342.8267212	2.98
358.6985474	3.25
368.1105957	0.32
375.8046875	0.43
394.6125488	0.66
410.6273193	6.66
424.2864990	0.55
426.8040161	8.29
442.6737671	0.58
470.5654297	0.44
471.4386597	0.29
478.7010498	15.20
483.9930420	0.27
494.7531738	100.00
508.7777710	0.60
510.6930542	42.15
560.8673706	0.54
562.0855713	7.05
562.7433472	49.25
577.7609253	0.16
578.5584106	8.30
598.9207764	0.12
600.1265869	4.49
601.3723755	0.26
622.7835083	1.57
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	377.09
Annotation	Unknow
Peak:m/z	Relative Intensity
178.9835815	0.38
191.1972656	0.05
197.2229919	0.31
209.1268921	0.07
215.1457062	7.74
275.8717346	0.11
281.2566223	0.11
289.1624756	0.10
315.8093262	0.04
317.2525940	0.07
331.3349609	0.09
332.6005859	0.07
341.2158203	100.00
359.4489441	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.1145
Annotation	Lactulose
Peak:m/z	Relative Intensity
194.1945953	0.02
195.2167358	0.05
224.8279419	0.06
270.7557373	0.06
285.3767090	0.04
297.2828674	0.03
323.2589111	0.03
341.2043457	100.00
354.9002991	0.01
369.4696350	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	375.145
Annotation	(3S)-7-Hydroxy-8,2',3',4',5'-pentamethoxyisoflavan
Peak:m/z	Relative Intensity
143.0043793	0.08
146.0649109	0.21
147.9051819	0.08
149.9398346	1.07
161.1382446	0.33
163.1864624	0.12
164.1264954	0.40
165.0826721	2.67
172.9189453	0.12
179.0269775	2.76
185.1509399	0.16
195.0993195	11.33
199.0889282	0.06
203.1135254	0.46
208.3535919	0.04
211.9945374	0.05
213.4206238	0.05
222.8651428	0.21
238.2948303	0.13
255.3192139	0.16
257.1763306	0.25
269.5317383	0.11
271.0787354	0.19
285.1831970	0.04
287.0268860	0.14
301.1312866	0.18
307.3144531	0.08
317.4396973	0.08
327.2161255	100.00
329.2433472	0.73
331.2423706	0.42
339.3477173	0.25
345.1075439	0.49
347.1336975	0.10
355.3079529	0.05
356.2505493	0.47
357.1915588	1.17
360.3689270	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1089
Annotation	Lactulose
Peak:m/z	Relative Intensity
99.0866699	0.09
101.0183792	7.64
107.1567230	0.19
113.0365219	17.23
115.2727966	0.76
118.9649887	18.80
125.0342102	2.16
130.9085388	7.82
142.9728699	16.41
149.0135498	4.23
161.0334167	21.20
178.9770813	100.00
196.9432373	0.12
221.1677856	0.15
225.0815430	0.32
233.0850220	0.21
277.1260681	0.16
280.9978027	1.86
295.1886902	2.17
299.0375977	0.14
323.4308777	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	401.109
Annotation	Veranisatin B
Peak:m/z	Relative Intensity
193.0765991	24.16
196.9353943	0.04
203.4020691	0.34
221.0737915	0.08
223.0562439	0.10
225.1044769	0.37
239.2512817	0.37
241.1132507	0.06
257.1424866	0.12
275.0198364	0.16
279.5194702	0.41
281.3094482	0.10
283.4243164	0.20
296.0353394	0.08
298.9779968	0.10
311.3680420	0.12
315.0723877	0.28
317.2967224	0.06
331.7585449	0.12
340.2427063	0.04
341.4717102	0.13
342.2210083	0.04
343.1313171	0.29
344.3699341	0.05
355.1788940	100.00
356.2612610	0.20
357.2561340	5.55
358.3895874	0.08
363.4484558	0.20
364.2345276	0.08
365.1332397	0.22
371.5125427	0.21
382.4142761	0.18
383.4249878	0.37
384.5100708	0.04
408.8769531	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	668.69
Annotation	Unknow
Peak:m/z	Relative Intensity
209.2435455	0.30
232.1355286	0.44
251.2280121	0.16
275.0254517	0.63
290.7165527	0.09
322.1551514	0.11
332.9180908	0.21
335.1579895	0.26
365.2181396	0.27
370.7626343	0.31
381.2750244	0.23
386.2821655	0.28
392.9844360	0.14
410.6053467	0.43
417.0001831	0.14
432.8186646	2.97
437.7398071	0.16
440.6759644	0.09
448.9370117	0.43
465.0675049	1.87
466.1429443	0.21
488.5064087	0.77
494.0011597	0.24
495.0234375	4.07
500.8722534	4.63
504.9747925	0.11
506.0570679	0.55
506.8131714	0.19
512.7776489	2.25
513.8717041	0.31
516.7337036	8.05
532.7113647	3.49
577.0252075	0.12
578.5107422	0.70
579.1472778	0.20
582.9949341	1.42
584.6703491	100.00
585.5115967	0.05
600.5996704	13.07
602.8987427	0.13
605.7254639	0.41
608.8468018	1.22
622.0592041	3.19
623.1633301	0.96
625.0340576	0.31
626.8524170	2.37
627.9575806	0.20
645.2538452	0.35
646.2763062	1.33
655.9970703	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	517.2289
Annotation	Cinnamoside
Peak:m/z	Relative Intensity
161.0928955	0.11
165.1108551	0.02
171.0623322	0.03
177.1224976	0.03
184.9938049	0.02
193.9953003	0.06
202.9982910	0.03
220.8410950	0.18
233.2632141	0.11
238.2492676	0.03
245.1787109	0.04
261.0034180	0.14
263.1036377	0.07
302.3026733	0.05
323.0715332	0.11
334.9186401	0.12
338.8742676	0.13
343.5589600	0.03
350.3723145	0.15
357.4263306	0.13
373.2192993	0.02
382.2554932	0.06
389.1893311	0.11
399.6148682	0.08
412.5424805	0.19
413.4692383	0.72
415.1520386	0.21
423.4237671	0.13
430.4488525	0.07
431.4247437	0.62
433.3207397	0.06
455.2149048	0.10
470.6829834	0.02
473.2907715	100.00
474.3301392	2.56
475.4025269	1.27
482.3710327	0.04
483.0588989	0.07
499.2761230	0.08
501.1753540	0.29
502.5828247	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	588.097
Annotation	DC 89B1
Peak:m/z	Relative Intensity
233.9116516	3.30
272.2174377	2.01
275.1116638	1.11
276.0816040	3.71
305.3867798	12.01
306.1269531	14.00
334.2141724	1.04
335.9566650	1.30
365.3146973	1.12
378.0676270	1.84
394.6423340	1.87
395.9692993	25.82
407.1881104	0.50
408.0437622	1.67
424.1630859	0.81
426.0040283	100.00
438.1818237	0.98
456.4332275	0.39
491.5206299	1.04
508.2973022	2.68
544.2319946	1.87
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	355.1013
Annotation	Chlorogenic Acid
Peak:m/z	Relative Intensity
117.1066284	0.58
134.9243622	2.21
136.1836548	2.21
145.2484741	1.21
145.9821167	3.84
154.0319214	0.43
163.0426483	63.58
164.07724	100.00
182.186554	1.21
192.9939117	1.93
193.9689026	4.99
200.9725952	1.58
275.1837769	0.60
311.2097168	0.77
316.357666	2.18
337.9621277	3.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	258.9
Annotation	Unknow
Peak:m/z	Relative Intensity
122.8872986	96.50
174.8722229	2.62
184.8972015	0.27
190.8515167	100.00
191.5123749	0.10
199.9705658	0.13
223.3277893	0.12
241.1719818	0.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	481.1044
Annotation	Unknow
Peak:m/z	Relative Intensity
153.8988800	0.29
181.0354309	0.42
184.1763306	0.73
231.1227264	1.33
277.2849426	0.10
316.9312439	0.10
319.2409973	1.96
324.2383423	0.98
333.1650391	0.23
334.6660461	3.17
335.3364258	0.80
352.1090393	100.00
352.7618103	0.14
385.1181030	0.48
435.1039429	0.13
463.3489075	11.97
476.8615112	0.48
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	353.0876
Annotation	ST077074
Peak:m/z	Relative Intensity
107.1303329	0.02
108.9136353	0.01
111.0430908	0.04
114.9160767	0.01
127.0558472	0.11
134.0611877	0.04
135.0793915	0.98
136.0848694	0.07
143.1308289	0.08
155.0704651	0.14
160.9447632	0.15
162.0383453	0.07
171.1676941	0.03
173.1108398	0.77
174.1433258	0.09
179.1079865	6.44
180.1357269	0.62
180.9382935	0.01
191.0429382	100.00
192.1346283	7.55
216.1633911	0.03
219.196106	0.01
224.7993164	0.03
227.2807617	0.01
233.0596619	0.38
234.280426	0.08
257.2759399	0.03
263.1286621	0.15
264.2803345	0.03
291.2061157	0.01
293.2575684	0.01
295.3052673	0.02
309.1351318	0.11
310.2332153	0.07
316.3000793	0.02
325.0539246	0.01
334.8760681	0.05
335.989563	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2418
Annotation	18-Hydroxyoctadeca-9Z,12Z-dienoic acid
Peak:m/z	Relative Intensity
85.0373764	0.26
93.01554871	0.16
95.04194641	1.20
96.98445129	1.17
98.57307434	0.35
104.8372955	0.15
108.9722366	1.57
112.9757462	0.41
119.0366974	0.53
120.9363174	0.16
123.0218506	2.39
124.9448242	0.58
127.2177353	1.57
131.0645294	0.16
133.0263367	0.10
134.9801636	0.74
137.089447	1.74
138.9893188	2.53
140.9364929	0.43
143.0743408	0.73
151.0289612	0.80
153.1268463	1.09
155.1052856	0.73
157.1853943	0.39
159.0994873	0.64
161.0211334	0.35
163.2223358	0.47
164.8876343	0.12
166.8910217	0.27
168.8936157	1.26
171.0336761	1.13
174.7132568	0.30
175.4422607	0.14
176.9752502	0.17
179.2785034	0.50
181.1164551	0.86
183.1139832	2.22
184.5680237	0.22
185.4397278	0.70
187.1990662	0.22
189.0455933	0.35
193.3139343	1.29
195.0461121	1.79
197.1455994	3.96
199.1004028	1.00
200.9687195	0.23
203.2886047	2.11
205.1139526	0.11
207.2088928	0.69
209.2958069	1.07
211.1786499	1.46
213.1599731	0.83
215.005127	1.06
217.355896	0.17
219.2342834	1.32
221.3153381	3.05
223.3168945	1.22
225.2592468	0.75
227.1244507	0.91
229.2101746	0.20
231.2087708	0.11
233.2521362	0.44
235.0657654	0.22
237.2767639	5.49
239.2008057	11.55
243.2931824	3.41
247.6242065	0.25
249.3110962	0.23
250.3672485	0.07
251.2341003	1.51
253.270813	1.75
255.1796875	2.18
256.3409424	0.20
257.1439209	0.35
259.1423645	0.25
261.2102661	3.54
269.2497253	0.65
274.9533691	0.48
277.1319275	0.31
279.2244873	100.00
280.2385254	0.42
281.1805115	0.37
282.4786987	0.36
288.4057007	1.61
296.3634338	0.09
297.3820496	0.43
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	413.14
Annotation	t(6)a
Peak:m/z	Relative Intensity
119.9781189	0.32
135.7968903	0.70
156.9658508	0.40
172.0519409	0.20
183.1868744	0.16
199.7293396	1.00
205.0270386	0.24
233.2815247	0.30
251.2161865	1.11
268.1236572	3.24
272.1401978	0.60
275.1734924	0.13
278.9987488	0.49
281.0979309	100.00
283.0483398	0.64
294.1035156	2.41
315.3943176	0.18
317.0209045	0.40
320.3322754	0.36
323.0132751	0.73
339.2461243	0.29
341.8595581	0.43
342.4681702	0.17
347.6802979	0.41
358.495697	0.49
367.4862366	0.29
375.0911865	0.53
384.959137	0.30
395.1420288	1.03
398.2801819	0.91
404.9546204	0.70
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1091
Annotation	5-O-(alpha-Mannosyl)-myo-inositol
Peak:m/z	Relative Intensity
96.99048615	0.30
100.9756775	7.63
106.8556442	0.24
110.8866119	0.10
113.0096512	18.80
114.8897705	0.07
116.3594208	0.41
117.1451569	0.09
118.9562073	11.84
124.9545441	3.29
130.9949493	6.06
136.9869843	0.06
143.0366211	20.97
149.0122375	2.18
155.2597351	0.14
159.0857239	0.18
160.3104553	0.33
161.0122681	18.83
179.0523682	100.00
181.0225067	0.06
202.7914886	0.28
220.8751526	0.83
244.9409485	0.10
253.0038757	0.26
255.3435669	0.15
269.3433228	0.12
280.890686	2.09
294.2290649	0.12
295.5736084	0.16
297.5411377	0.16
305.1411133	0.32
322.4029846	0.12
323.5715637	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	522.7
Annotation	Unknow
Peak:m/z	Relative Intensity
174.9607239	0.04
213.1085815	0.36
337.1166382	0.09
338.9607544	0.33
341.1777954	0.09
343.0737305	0.16
348.2958374	1.06
348.9171753	5.27
354.9566650	0.35
362.0856934	0.11
368.8591309	0.10
370.9647827	1.74
386.2443237	2.16
386.8704834	3.97
387.5042114	0.47
430.1606445	0.12
431.9003296	0.11
433.3991089	0.30
436.5120850	0.15
438.7882080	100.00
443.0612183	0.12
454.7773438	37.99
466.1647949	0.13
504.1720581	4.91
505.0834961	1.42
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.1143
Annotation	Lactulose
Peak:m/z	Relative Intensity
143.0285797	0.01
149.1274719	0.03
167.0446167	0.02
179.0818176	0.01
225.0693665	0.01
298.1854553	0.07
341.1945496	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	470.1581
Annotation	Unknow
Peak:m/z	Relative Intensity
122.8277740	0.47
144.5550232	0.27
161.9972382	1.28
163.1954498	0.65
179.2022705	1.35
190.8937378	0.56
233.3707123	0.87
284.1658020	0.22
308.0856934	100.00
313.3446045	1.30
341.1213989	0.40
363.4012451	1.09
406.3151245	1.93
425.4861145	0.43
428.2738647	0.58
430.9561462	0.27
433.9004822	0.52
450.2839966	0.77
451.1346436	0.40
453.0745239	0.66
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	255.1332
Annotation	Midodrine
Peak:m/z	Relative Intensity
81.0887833	0.12
96.9034119	0.15
109.3463593	0.16
121.0960236	0.13
122.8201752	0.09
125.1744995	0.09
128.9611206	0.09
130.1758423	1.29
135.1275482	0.28
136.9909973	0.23
144.1737061	0.11
147.0202789	0.11
154.9036102	0.03
161.2115936	0.05
162.8531342	0.46
164.0406036	21.80
165.1035767	0.16
166.8664703	0.08
173.0029144	0.17
176.9039459	0.29
181.0881195	1.38
189.2837372	0.12
191.1533966	0.24
192.9677277	0.12
194.9299469	0.29
199.2624512	0.15
201.0733490	0.12
206.6725922	0.11
209.1955872	0.20
211.1329193	0.05
213.9483032	0.09
219.1215515	0.79
220.4167480	0.06
224.8350983	0.27
226.9928589	0.11
232.0694580	0.15
235.6402130	0.06
237.0930939	100.00
238.0822296	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	652.71
Annotation	Unknow
Peak:m/z	Relative Intensity
206.8940125	0.32
212.9795532	0.13
232.1545105	0.69
233.9271545	0.07
234.8545380	0.72
289.1485901	0.08
290.9765930	0.08
302.0573425	0.11
315.8895874	0.10
332.9725342	0.06
348.8778076	0.41
364.8466187	0.30
377.2664185	0.11
384.2902832	0.07
401.1462402	0.12
402.7993774	0.06
403.4663086	0.05
407.0368042	0.39
408.2987061	0.09
416.7352295	0.94
430.0919800	0.05
432.8626099	2.07
440.1931152	0.16
448.8070679	0.43
449.4269409	0.33
471.1593628	0.19
477.0704956	0.24
478.8435669	0.81
484.7323608	1.03
485.3602295	0.10
488.8654175	0.34
489.9082642	0.29
494.7988281	0.30
496.7177734	1.69
500.8516235	10.35
515.2010498	0.15
516.7434692	9.35
520.0357056	0.06
521.0663452	1.08
522.2438354	0.15
540.8142700	0.11
541.8983154	0.26
566.0181274	0.18
566.9965210	0.32
568.7030640	100.00
569.3522339	0.31
583.1738281	0.17
584.6232300	32.11
585.3066406	0.32
605.8443604	2.88
606.8463745	0.28
610.7713623	0.41
617.6303101	0.06
628.4473267	0.26
629.4687500	0.79
630.4346313	0.20
634.2876587	0.19
642.8693237	0.22
658.9047241	0.21
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
135.0957947	13.10
149.0237579	100.00
149.9258423	36.21
166.1512451	4.91
166.9798584	2.55
168.0780182	4.40
195.2491455	9.90
262.1708374	15.16
263.1650085	4.35
278.4820862	6.64
279.2647095	16.36
280.2145691	36.88
297.4959106	7.12
373.7889404	26.85
374.4328003	9.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0854
Annotation	2'-Methoxyflavone
Peak:m/z	Relative Intensity
80.900177	5.46
97.08578491	0.91
102.9787598	2.96
108.7507172	1.00
110.9244232	1.51
120.8730927	1.39
123.3166046	3.63
129.172226	7.77
133.0915833	1.62
134.9370117	2.51
137.2707672	3.71
141.0265503	1.26
143.0816803	1.23
144.9373779	2.96
148.1364441	1.62
149.0036163	1.51
150.9763336	100.00
152.9589996	3.84
155.200882	1.21
157.0015259	1.58
161.0881805	3.67
166.9937286	3.96
171.1969452	9.05
179.1678314	8.41
181.352066	3.14
185.4611206	6.48
189.2089691	5.85
193.0219574	9.14
195.2634277	5.93
197.2310181	6.54
207.1644287	10.07
211.0435944	3.08
211.9713593	1.80
214.9050751	2.33
217.0975189	25.89
225.1799469	13.89
235.1755524	61.63
237.5520172	12.95
238.1522217	17.47
239.0707855	4.98
244.0619049	4.51
251.1949463	1.98
252.0215607	5.43
253.0895538	70.36
253.7179108	2.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.1143
Annotation	Unknow
Peak:m/z	Relative Intensity
126.0938034	0.12
174.9764404	0.04
184.9625549	0.13
215.0119171	0.11
281.2111816	0.12
320.8840332	0.07
326.1469116	0.03
327.8457642	0.03
332.1521606	0.05
341.1921692	100.00
342.2863159	12.21
344.0094604	0.27
358.3086853	0.14
360.1852112	0.14
369.5473633	0.23
370.3009338	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	540.141
Annotation	Unknow
Peak:m/z	Relative Intensity
162.1075439	0.90
169.7924042	0.08
178.9981537	0.69
180.0814209	0.09
187.2976990	0.13
206.9380798	0.11
215.1439514	0.10
220.5562744	0.22
233.1522675	1.54
242.9914856	0.17
245.0632019	0.10
251.0872192	0.09
272.4061890	0.23
284.3447266	0.47
289.9652100	0.63
291.4110107	0.08
308.2401733	10.62
318.1129761	1.95
319.1334229	1.47
336.1085815	30.09
344.1649170	0.68
358.1619873	0.52
362.3994141	0.46
368.9857178	0.27
369.9754028	0.09
375.0387573	0.43
375.8233032	0.09
378.3267212	0.61
392.5194702	0.15
393.2002563	2.67
394.1242676	0.17
402.2369995	0.89
411.1510620	100.00
411.7781982	0.71
413.1466064	0.50
420.0502319	0.49
429.3760986	0.29
431.2799683	0.15
447.3102417	1.86
448.5618896	0.08
455.6300049	0.10
465.2131958	10.75
477.2726440	0.08
494.0588379	0.27
496.2463989	0.13
504.4541016	0.20
522.3438110	7.43
523.5243530	1.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	380.77
Annotation	Unknow
Peak:m/z	Relative Intensity
146.9927979	0.11
192.0018768	0.29
196.8232117	0.18
209.1186066	4.03
209.9694214	3.98
210.9963226	5.74
212.9266052	10.81
217.7593384	0.25
223.8701782	0.20
246.8886414	0.29
247.9171143	7.19
249.3005981	0.54
251.1044312	2.60
252.1335144	0.10
269.9690552	0.22
288.9494629	0.11
294.2942200	0.44
296.7752075	100.00
300.1091003	0.32
312.9508057	0.12
320.1895752	0.15
321.2761841	0.40
334.7673035	35.96
335.3812561	0.65
337.0661011	0.11
362.1993713	0.80
363.2229919	2.68
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	349.0546
Annotation	2-O-(alpha-D-Glucopyranosyl)-3-phospho-D-glycerate
Peak:m/z	Relative Intensity
106.7886276	0.28
122.9641342	5.56
134.9325256	1.25
141.0006866	2.91
145.094101	5.57
147.0545959	0.61
162.9699402	82.07
165.1324158	0.36
168.9952393	100.00
172.9309692	0.45
175.170166	0.46
181.0611267	0.88
182.815918	1.15
186.8910217	0.16
188.8755493	0.29
191.1690979	0.87
194.942337	1.48
197.0904999	0.28
199.045929	0.48
209.2091522	0.40
215.2528076	1.79
217.0536194	0.26
218.9894714	1.47
220.7719421	0.97
225.2642212	0.33
227.1405334	0.44
235.3126526	0.28
238.9727173	0.19
240.9640503	2.18
242.931366	0.79
256.7522888	0.97
259.0616455	3.77
269.1619568	5.52
285.1221924	24.61
287.03302	8.10
287.6903076	0.47
295.1195068	2.08
299.0315247	0.24
303.1075134	5.49
305.1717529	2.49
308.244812	0.70
311.9744873	0.33
313.037323	39.12
331.040802	16.54
337.2890625	1.78
339.0758667	0.29
349.0578308	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	275.01
Annotation	2-(2-Chloro-phenyl)-5-(5-methylthiophen-2-yl)-[1,3,4]oxadiazole
Peak:m/z	Relative Intensity
80.8845062	3.95
87.2095566	0.07
112.9020386	0.10
131.1697388	0.08
136.9404297	0.25
142.3813782	0.11
143.0388641	0.18
145.0782166	0.18
147.0432434	0.04
149.0922546	0.06
151.1388550	0.06
155.1602936	0.16
158.9953461	0.04
163.0516663	0.06
173.0518188	0.07
177.0977478	0.20
177.9856720	0.07
178.6793060	0.03
181.2220459	0.14
187.2397156	0.12
191.1471100	0.10
193.0278778	100.00
195.3074341	0.27
197.0478821	0.07
199.1518250	0.21
200.8692932	0.21
203.3671570	0.15
211.0953064	0.08
213.1636353	0.65
214.4797058	0.06
215.1107788	0.15
216.3853455	0.18
226.8189392	0.15
229.0227356	0.41
231.0891113	0.85
239.2445374	1.25
241.3327026	0.18
243.3936157	0.08
246.9503174	0.25
255.1420288	0.07
256.0137634	0.58
257.1752319	6.60
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
94.89923096	1.90
98.93746185	0.59
108.8848877	0.27
110.9990463	0.13
112.9887161	0.73
116.6950302	0.33
117.3305359	0.28
119.1258698	0.81
120.9663239	0.42
122.9642487	0.40
123.7526474	0.63
124.8893585	1.26
127.0872269	0.80
129.087677	0.96
131.0043335	0.58
133.1600037	0.23
135.3441925	0.34
136.7359467	1.02
138.9474487	0.55
141.1872864	1.20
142.2636719	0.41
142.8898621	1.28
145.1195679	0.10
149.3224945	0.34
151.0860901	0.12
153.1304932	0.29
155.0201569	2.22
156.9356537	0.40
159.1665039	0.27
163.1661987	2.21
165.151947	0.12
167.2249146	2.00
168.222229	0.53
169.1880493	3.41
171.1054535	1.50
173.0528412	2.09
177.1038513	2.82
181.1374054	1.62
182.0809021	0.32
183.2655487	0.98
184.9443665	0.21
189.5617981	0.18
191.0829926	0.83
193.1527557	1.39
195.0067596	1.56
197.0501099	3.00
198.8851624	0.37
204.2754211	0.31
205.3288269	1.07
207.1128235	0.94
209.269165	0.42
210.0956421	0.15
211.2782898	1.41
213.1087952	0.55
215.0677185	1.67
217.1469421	0.37
219.4764099	0.23
221.2303162	0.28
222.2955627	0.19
225.117218	1.61
227.2368469	1.08
233.1906128	0.73
235.0597534	1.46
237.2596741	1.69
239.1728821	1.56
241.0784302	1.34
247.3480225	0.86
249.300354	0.46
251.2325439	2.99
252.2408752	0.40
253.1796265	6.09
255.2467957	1.15
257.3845825	0.73
264.3297729	0.32
265.3235474	0.81
266.7922058	0.66
267.5672607	0.34
268.3693542	0.59
269.3796997	1.36
270.3112488	1.54
273.8718872	0.59
275.151062	24.47
275.7579956	0.63
279.1774902	1.07
281.5870667	0.65
282.7650146	0.31
283.3982544	0.64
293.2036438	100.00
294.1546936	1.75
301.677063	2.00
309.4706421	0.59
311.3634949	0.39
313.0093384	0.94
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	501.2339
Annotation	3-Oxo-alpha-ionol 9-[apiosyl-(1->6)-glucoside]
Peak:m/z	Relative Intensity
167.0685272	0.07
170.2413635	0.03
173.0593567	0.55
178.9631348	0.05
185.2235107	0.12
203.1426392	0.05
204.3153076	0.06
234.9536438	0.08
269.1810303	0.05
287.0904541	0.16
305.1746521	0.22
311.6788940	0.07
315.4153748	0.06
329.5042725	0.07
335.3299866	0.31
341.1972961	4.57
344.3067627	0.13
349.2376404	0.04
359.3318481	0.09
371.3273926	0.10
373.3044434	0.17
385.2123108	0.10
389.1795349	0.03
393.2437439	0.09
397.0427551	0.76
409.4321594	0.19
411.2322388	0.05
413.5095215	0.22
415.4833984	1.44
416.2205505	0.03
422.1229553	0.10
425.4501038	0.11
426.9300232	0.06
429.2806396	0.02
439.4764709	0.07
443.3547668	0.41
457.2469482	100.00
458.3392029	2.55
459.2442932	0.71
459.8554382	0.02
465.0152283	0.19
471.6062927	0.11
484.4298401	0.12
485.4541931	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	375.0911
Annotation	Unknow
Peak:m/z	Relative Intensity
108.9955978	0.53
126.9251328	100.00
128.9944000	0.32
130.9430237	0.19
144.9454346	0.33
147.7778931	0.92
163.2890320	0.30
167.0970154	0.10
183.1472168	0.09
184.1486664	0.20
189.1314392	0.24
193.0341949	0.29
199.1684570	0.75
202.2898560	0.21
203.1214294	0.26
205.0664673	0.33
212.7948456	0.52
216.4244690	0.44
227.1614075	2.62
228.0039978	0.67
230.8420410	1.13
248.3038330	0.22
257.3270874	0.39
260.0915833	0.28
271.1207886	0.48
276.3104858	0.10
285.2731628	1.00
289.1597900	0.61
295.1420288	0.17
308.7880859	0.13
310.3600769	0.34
311.2670898	0.26
314.8125610	0.58
326.0360107	0.26
328.4927368	0.81
329.1032104	1.07
330.1952515	0.26
331.4656372	0.23
338.2731934	2.26
339.1755371	3.03
345.0992432	0.64
356.2477112	1.72
357.2850342	2.61
365.9737854	0.58
373.3411865	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	332.5608
Annotation	Unknow
Peak:m/z	Relative Intensity
105.9175339	0.69
118.0820770	0.17
122.9711151	46.13
123.6142731	0.18
135.9517059	2.27
138.9446106	0.26
160.9711609	0.24
163.2089844	0.11
198.0858459	0.67
198.8841553	0.34
209.1113586	0.39
216.0634460	0.13
218.5303650	0.32
231.1103821	0.26
232.1502380	3.07
240.9589844	0.20
241.6351013	0.13
242.9743958	0.60
251.0883179	0.26
253.8466187	0.52
255.4101257	0.53
256.0114136	0.48
272.9053650	0.13
286.2035828	0.44
287.3900146	0.34
288.2666016	0.47
296.0560913	1.41
304.3453979	0.88
314.2000732	2.30
315.0610352	0.84
323.1477051	1.64
348.3007812	0.49
371.2153625	0.25
380.8019714	0.12
428.0995483	0.86
434.4485474	1.17
437.8809204	0.32
444.2127075	0.95
511.0121155	0.64
524.2283325	44.85
528.8624878	0.82
542.1148682	100.00
543.2189331	1.85
543.9196777	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	307.0827
Annotation	Oxidized glutathione
Peak:m/z	Relative Intensity
101.9759369	0.10
127.1321945	0.36
129.9925232	66.12
130.9739685	3.07
145.2107849	0.45
152.0588379	0.20
162.0077209	0.43
176.8712769	1.06
178.8685913	2.49
199.2962646	0.27
205.1780701	0.13
209.1563721	0.35
211.2787476	1.05
218.6392822	0.42
219.8790894	0.88
231.1698608	1.71
232.3460693	0.40
233.1192322	0.34
235.1205444	0.46
242.5846558	22.72
243.1917114	6.14
244.2115479	0.13
245.1993713	0.62
246.8084412	1.08
248.8746338	0.20
256.1873169	0.14
260.7169800	1.10
265.0983887	0.75
266.9655151	1.72
269.7127991	29.31
270.8334961	0.26
271.5478210	0.20
274.4026794	0.44
275.5594788	47.32
276.2689514	8.21
277.4568787	0.38
278.7745972	1.10
284.1284485	0.77
288.0935669	1.08
289.0331421	1.17
298.7333374	85.50
321.9339905	0.47
337.3142395	0.42
338.2395325	0.74
355.1842346	100.00
356.1694031	8.37
364.1404724	0.51
364.9555359	0.42
381.1454163	7.64
382.2409973	0.25
409.2204590	10.89
421.2465515	0.46
422.5068054	0.14
466.4568481	2.68
467.4883118	0.15
475.4279175	0.25
484.2041626	62.19
485.2884827	10.59
520.2091675	0.47
538.3348999	12.38
539.3064575	1.63
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	594.2225
Annotation	Unknow
Peak:m/z	Relative Intensity
222.1225281	1.42
229.1969299	1.81
252.2491608	7.99
253.0748291	3.96
259.0328369	1.95
271.0270996	6.09
288.9223022	12.21
305.7257080	2.20
306.8286743	6.21
317.0584106	0.38
324.9842529	100.00
342.6374512	19.65
414.2352295	3.97
432.1759033	60.56
447.5319824	0.48
451.4869995	1.28
486.8310547	6.25
503.9849854	3.61
504.8894653	2.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	362.1225
Annotation	Cyclomegistine
Peak:m/z	Relative Intensity
125.0644913	0.73
161.0802612	1.09
221.2845764	1.56
230.1042786	1.43
251.2734985	0.83
253.1199646	20.71
254.2090149	0.52
270.3167114	2.43
281.0981750	6.57
298.0288696	10.25
299.0669861	35.96
313.1796570	2.04
316.0902100	100.00
326.0897522	2.24
327.3918152	0.58
331.3724670	0.35
334.1867065	0.28
344.0533447	21.86
345.1017151	12.99
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	432.1701
Annotation	Unknow
Peak:m/z	Relative Intensity
126.2271881	1.94
127.0477066	4.51
144.8487549	12.09
162.8204803	8.89
180.8485413	1.41
195.1586151	1.41
223.1746979	0.96
246.8225708	0.80
252.0318604	32.67
258.8152771	7.48
270.0048218	72.43
271.2241516	6.43
277.0350952	0.66
288.2462158	2.11
289.0670166	15.75
296.4880066	0.83
306.7783813	9.14
324.9789429	100.00
342.9884644	17.08
396.1233215	2.30
414.1134033	4.64
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.14
Annotation	Sophoraflavanone B
Peak:m/z	Relative Intensity
107.0250015	1.15
108.2527771	1.49
109.1099472	2.06
111.0759201	0.36
113.0072861	0.47
125.0038605	0.92
135.0806274	0.59
136.9857483	12.96
138.9147644	0.32
147.2254028	0.83
149.0454712	1.80
161.1479645	9.67
165.0529480	0.39
169.1592712	1.93
171.1106873	1.53
175.0160522	14.11
177.0122375	1.12
179.0650177	4.46
187.2321777	0.61
195.9664001	1.29
197.9461517	0.50
199.1282196	2.14
200.8775330	1.33
211.5929871	0.55
217.1700745	6.83
227.1856995	1.63
231.0850830	0.87
267.1726074	1.40
277.4366150	2.31
283.1613464	0.47
285.6052246	1.02
291.1445923	4.22
297.0562134	0.46
299.3005981	1.22
302.9649658	0.55
305.2475281	0.93
311.1796265	24.71
317.5549011	1.21
323.2716064	100.00
324.8628540	1.16
341.3944092	1.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	353.0876
Annotation	Chlorogenic Acid
Peak:m/z	Relative Intensity
108.9334412	0.01
127.1149826	0.01
132.9966431	0.02
133.8953552	0.02
135.0672302	0.80
135.974411	0.08
137.0958099	0.01
149.1065369	0.02
153.0793762	0.02
155.2346802	0.04
161.050827	0.43
162.2265015	0.04
171.2396851	0.03
173.1252899	0.51
174.3055115	0.05
179.0768738	6.65
180.0195007	0.67
191.049469	100.00
192.0450439	5.10
196.094574	0.02
215.1915283	0.03
218.2189636	0.01
225.1951904	0.01
233.1098022	0.52
234.20401	0.06
245.0696411	0.01
250.3946533	0.01
262.8695679	0.05
275.1654663	0.01
276.9541321	0.02
292.2059937	0.03
295.3941956	0.03
309.3154907	0.05
310.2073364	0.01
311.1342163	0.01
335.161377	0.07
336.3158569	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	538.1254
Annotation	Unknow
Peak:m/z	Relative Intensity
162.0227356	0.20
169.3939514	0.18
179.0359802	0.73
187.2130127	0.16
187.9320374	0.08
199.3385010	0.09
205.1451721	0.13
206.9370575	0.23
214.7025909	0.13
215.6359558	0.33
232.1538239	0.04
233.0475769	3.34
251.1173553	0.12
263.8399353	0.05
284.1600952	0.73
290.1989746	0.29
291.2253418	0.40
300.8464966	0.04
306.0664673	0.57
308.2056885	7.40
310.0924072	0.06
318.1289062	2.51
319.1055298	1.16
334.0340576	0.93
335.2085571	4.14
336.1633911	30.39
344.4574585	0.10
347.3019409	0.07
362.1419067	0.85
367.3884277	0.07
374.0526123	0.05
375.2098999	0.18
376.8596802	0.15
380.0641479	0.17
385.2499390	0.07
393.2413330	5.54
394.1230469	0.75
402.0541992	0.77
409.4114380	2.73
411.1317139	100.00
411.7728882	0.50
413.3624878	0.58
421.1900635	0.19
437.0446167	0.37
447.2915649	0.77
459.1372681	0.16
465.2991943	14.36
476.2445679	0.22
477.0647583	0.15
504.2660522	0.58
506.1893921	0.09
522.1662598	9.06
523.4026489	0.65
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	516.8979
Annotation	Unknow
Peak:m/z	Relative Intensity
159.0297699	0.63
175.0321960	0.46
199.0160217	0.24
215.1962280	0.04
229.1024323	0.03
244.6154633	0.02
245.2330780	0.08
272.9752808	7.81
288.9840393	7.95
323.2374268	0.04
386.9289551	0.54
387.5969849	0.03
400.2807007	0.06
401.1472168	0.17
402.9893188	100.00
424.1972046	0.07
442.9421387	0.05
461.0019531	0.05
470.7720947	0.13
472.0283813	0.11
473.0046387	0.33
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	427.5629
Annotation	Unknow
Peak:m/z	Relative Intensity
129.0972595	0.38
132.0150604	0.66
136.5073700	2.61
137.1959686	1.38
139.0344391	0.58
147.0655975	1.49
162.3382721	0.19
179.1039124	6.89
180.1201935	0.50
185.0132599	4.27
196.0943756	15.32
197.9749451	0.35
203.1542969	3.15
229.1095581	0.38
242.6746216	0.83
265.1997375	0.19
265.9106140	0.67
269.2929688	0.76
273.4492188	1.52
274.2664795	0.87
279.2073975	0.23
287.2008057	1.04
288.4414062	2.01
296.7694397	4.70
301.2514648	16.63
302.2294922	1.18
310.1792908	0.44
311.3797607	0.45
315.0590820	10.86
315.6757202	0.25
320.2789612	1.74
322.1837769	0.17
324.6887817	4.56
325.4639893	0.40
330.7881470	0.19
335.2713928	0.35
337.2430115	0.21
339.3095398	0.53
347.3934326	2.43
348.3630981	0.67
353.4937134	10.26
354.1046143	0.46
357.5496826	1.38
362.8760376	8.56
367.2716980	0.53
367.9571533	1.60
374.1422424	0.21
379.9356995	1.56
381.1294250	1.13
385.6941833	5.04
386.3068237	1.28
387.5894165	0.90
388.6427612	2.24
389.7742615	0.41
391.8404236	0.78
393.3922424	1.17
398.0700378	1.27
407.8838501	27.67
408.6787109	0.53
409.3478699	0.37
410.2810669	2.05
415.3893127	0.43
416.9758606	5.25
417.7270813	1.38
419.5787048	0.44
438.4785461	2.14
439.3882751	0.97
465.2990417	0.26
475.3140564	2.61
476.8788452	0.19
482.6980591	1.30
483.5887146	0.20
491.1041870	3.15
494.0152283	3.21
505.4534302	5.29
506.4130249	1.27
511.5092468	5.30
512.4515991	4.74
529.5969238	4.19
534.9162598	1.13
538.7406616	0.17
543.6661987	100.00
544.6510010	8.20
545.4380493	0.55
557.0927124	0.77
558.8137817	0.23
570.1510620	0.64
572.7056274	9.45
573.5841675	1.14
575.1099854	0.43
575.7438354	0.46
619.2880249	2.03
620.4403687	0.97
621.3861694	0.26
630.6141968	0.57
633.5798950	5.27
634.5488892	5.45
639.9720459	0.28
640.6741333	0.67
648.3223877	3.85
649.4218140	1.52
716.2636108	0.76
717.7637329	0.58
731.6426392	0.43
734.6593018	0.45
739.6840210	0.42
755.8152466	0.16
767.7856445	0.33
768.5729980	0.37
770.5657349	0.61
776.5507202	0.58
779.5597534	0.98
785.6300659	10.57
786.6231079	1.95
787.8142700	1.14
788.9555054	0.16
830.5596313	0.52
948.8264771	0.79
949.5890503	0.61
1181.8568120	1.83
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2419
Annotation	Moniliforminol A
Peak:m/z	Relative Intensity
91.00136566	0.23
92.92405701	0.61
94.92053986	0.47
96.88728333	1.28
98.88866425	0.38
100.9525604	0.18
105.1118622	0.75
107.0396271	0.07
108.5128326	0.14
109.1657104	1.05
111.0133286	0.11
112.7790833	0.71
114.9143372	0.28
118.9415588	0.08
120.9524536	1.22
123.0709839	1.28
125.0957947	0.12
127.0400238	0.18
128.727951	0.15
131.1434174	0.14
133.1395264	0.46
135.1462097	1.45
137.0596619	0.73
138.9622803	1.93
141.0267334	0.48
147.0823364	1.49
149.1499023	0.54
151.2185974	0.15
153.0872345	2.86
155.0314636	0.42
156.207016	0.36
157.1174774	0.43
158.8603973	0.07
160.9828644	0.95
163.0840149	0.56
165.124588	0.52
167.1867371	0.91
169.0947113	1.56
171.1270752	1.42
172.9551697	0.22
174.9881287	0.49
176.8262329	0.80
179.1667786	2.34
181.2395172	1.73
183.0410614	1.36
185.1041565	1.57
189.2454834	0.72
191.2899323	0.56
193.1651306	0.69
195.6993713	0.39
197.0914459	4.61
199.2094421	1.59
203.2705078	1.46
207.3622131	0.10
209.270752	1.69
211.1542358	1.79
213.3792725	1.18
215.0301819	0.11
217.4313049	0.22
218.1427002	0.16
219.198761	0.62
221.1756287	4.37
221.8649292	0.11
223.1670532	1.75
225.1499939	2.91
227.0318298	0.71
227.6876526	0.15
233.2542725	3.22
235.3866272	0.52
237.1851501	4.38
239.2264709	14.70
240.1456299	0.17
241.2923584	0.57
243.1903992	1.97
244.5917358	0.14
245.3135986	0.22
251.2667236	3.85
253.1812744	0.61
255.333313	1.99
256.2541504	0.47
257.0904541	0.76
261.2471313	3.28
262.0040894	0.07
277.2834473	0.37
279.2346191	100.00
280.0324707	0.48
281.5732727	0.13
287.7042847	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	205.1
Annotation	Tryptophan
Peak:m/z	Relative Intensity
68.82458496	0.09
86.86053467	0.42
96.00634766	0.18
96.95108032	0.39
102.6711731	0.16
107.049469	0.26
108.6663208	0.67
110.9477386	0.43
114.8214111	0.94
125.8953552	1.06
127.0392151	1.27
129.0506592	0.45
133.1845703	0.12
135.2233582	0.08
138.7550201	0.37
144.8864441	2.11
146.0544128	0.42
151.1194153	0.08
156.8880463	0.10
158.935379	0.32
163.1464691	0.39
167.0551758	0.18
168.8400421	1.68
177.033905	1.07
181.9947815	0.12
186.9984283	2.76
188.0973663	100.00
195.397049	0.17
196.0374756	0.15
205.0084686	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	353.0876
Annotation	Chlorogenic Acid
Peak:m/z	Relative Intensity
107.0391846	0.01
112.1285858	0.02
127.0061111	0.04
133.2522888	0.02
133.8894806	0.03
135.0818481	1.17
136.1916046	0.09
143.0651855	0.03
154.9221191	0.06
161.077652	0.49
162.1152039	0.08
171.304718	0.01
173.01474	2.66
174.1174164	0.14
177.02005	0.02
179.0657043	7.15
180.1244202	0.60
191.0532379	100.00
192.134079	8.39
193.1178284	0.02
205.0101929	0.01
217.3010254	0.04
221.1735229	0.01
233.0675964	0.07
236.9924622	0.02
250.3040161	0.01
263.0320435	0.01
272.1737976	0.01
278.8979797	0.03
290.3942871	0.01
295.3908081	0.02
302.4266052	0.01
307.1373291	0.05
308.0872192	0.03
309.4170227	0.19
311.1725464	0.01
336.0491943	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	285.1844
Annotation	2-(3,7-Dimethyl-2,6-octadienyl)-4-hydroxy-6-methoxyacetophenone
Peak:m/z	Relative Intensity
81.0759735	0.23
85.0068817	0.13
87.7675629	0.10
90.8509216	1.93
92.9478683	2.41
94.9661102	0.89
96.9707794	0.40
98.9498596	0.68
103.0544128	0.50
104.9922028	1.81
106.9315796	3.63
108.8570786	0.88
112.9897919	0.56
114.9593506	4.87
115.9335480	0.24
117.0520782	13.03
118.0019989	0.22
119.0193710	2.37
121.0167007	1.39
121.6500244	0.09
122.9640732	1.34
126.9765625	7.49
128.9902344	7.06
131.0526733	10.04
133.0359192	4.47
134.9561768	0.37
137.0232239	0.73
139.1486511	0.49
140.9184418	6.45
143.0151062	6.67
145.0012970	60.93
145.9817810	1.15
147.0598145	7.22
149.0283508	27.83
150.0788269	0.16
151.0590820	0.73
153.0046692	1.77
154.1958160	0.87
155.0967560	5.64
157.0639954	19.64
159.0621948	27.18
160.1181793	0.11
161.0820007	4.82
163.1351929	0.54
165.0948181	1.52
167.1275940	1.88
168.0696106	2.98
169.0500641	8.39
170.3772583	0.82
171.1316833	7.26
172.3108368	1.86
173.1625671	9.18
175.1298676	4.25
177.0779572	1.83
179.1268921	2.59
180.9213257	2.22
182.0220337	13.98
183.0435333	20.24
183.6749878	0.07
185.0571594	10.89
186.9438782	8.04
188.1560974	0.13
189.1458740	0.51
193.0273590	1.43
195.1889954	0.10
195.9950562	0.81
197.1246033	7.88
199.2313232	2.57
200.5204773	1.25
201.1806335	7.62
203.2723694	0.24
207.0780334	0.59
209.3125916	0.75
211.1121216	3.58
211.7806702	0.32
213.1198425	3.39
215.0326233	3.99
217.2446594	1.02
219.1311951	0.65
220.3296814	0.10
223.4551392	0.15
225.1643066	5.36
229.2541504	0.16
238.3060608	0.61
239.1597290	0.53
241.2075500	12.33
243.1866455	100.00
243.8908081	0.29
249.2969360	1.38
252.2697144	1.73
256.5421448	0.89
257.3535461	1.19
267.2340088	12.60
283.0661011	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	302.99
Annotation	Unknow
Peak:m/z	Relative Intensity
122.7621460	100.00
141.0321808	5.09
171.3497467	0.45
196.9847565	0.90
206.0067139	0.56
214.0309143	0.42
218.8207703	1.41
234.9018555	3.76
245.0008850	0.45
257.0765991	0.43
285.2887573	1.65
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	541.13
Annotation	Resveratrol 4'-(6-galloylglucoside)
Peak:m/z	Relative Intensity
161.1609802	0.18
161.9977722	0.03
179.0332031	0.67
179.9964905	0.11
181.1859894	0.11
221.2071228	0.39
222.0627899	0.13
233.1151581	0.21
249.2958069	0.03
262.7290344	0.32
263.3384399	0.33
263.9728699	0.12
276.2382202	0.04
280.8577881	0.14
311.1499023	0.02
323.1326294	1.65
324.1402588	0.21
325.2627563	0.28
340.9724121	0.49
342.2267456	0.18
343.0633545	0.07
347.1846313	0.09
356.1173096	0.13
357.4440308	0.09
359.2984619	0.04
360.2448120	0.05
361.2822266	0.08
377.1920166	0.93
378.1793823	1.83
379.3005371	4.62
383.2602539	0.63
384.3239746	0.04
385.4370728	0.06
396.5130005	0.06
413.0845337	0.05
414.2780762	0.02
442.9536743	0.04
443.8082886	0.19
444.4248657	0.09
485.4324341	0.08
503.3133545	100.00
504.2952881	66.07
505.2785645	17.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	506.72
Annotation	Unknow
Peak:m/z	Relative Intensity
212.8770447	0.85
216.2147522	0.10
233.2186279	0.15
282.0199280	0.13
332.9527588	23.00
339.0982971	0.08
353.9242554	0.71
354.9775696	1.84
370.8250427	19.82
371.6375732	0.39
386.9990540	0.71
422.8876343	86.88
436.6466980	0.15
438.7301331	100.00
439.3476868	0.25
460.1572571	0.61
488.1447449	3.60
489.1676636	0.64
514.6188965	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	565.0475
Annotation	UDP-D-galactose(2-)
Peak:m/z	Relative Intensity
163.0831909	0.07
164.2154999	0.02
193.1037292	0.16
211.1135254	1.97
212.2285767	0.09
219.1411133	0.05
233.1194305	0.01
241.1189575	0.87
242.0822601	0.06
262.2985840	0.02
273.1695557	0.14
280.0317078	0.70
281.0042114	0.18
292.8287964	0.02
303.2109375	0.02
305.2482910	0.19
321.1543579	0.74
323.1520996	100.00
324.1535645	9.80
345.7468262	0.02
385.0867920	1.88
386.1356201	0.14
390.9998779	2.02
392.0421143	0.04
403.1976929	2.09
404.1740723	0.16
428.9736328	0.58
430.3401489	0.34
430.9575806	1.38
467.1514282	0.20
468.2575073	0.13
479.8660278	0.03
481.0236206	0.22
481.9934082	0.39
482.7211914	0.26
497.9039917	0.04
519.6525879	0.06
542.8970337	0.02
547.3516235	0.73
548.1256714	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	274.873
Annotation	gamma-Pentachlorocyclohexene
Peak:m/z	Relative Intensity
122.8228836	23.99
189.0513611	0.04
190.8669739	100.00
206.8242188	56.35
217.1826782	0.07
229.0390015	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.1144
Annotation	Lactulose
Peak:m/z	Relative Intensity
179.0865479	0.02
225.0179749	0.04
256.0512695	0.02
271.2631531	0.03
295.4816895	0.05
298.0219116	0.02
341.2646484	100.00
356.1583557	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	425.01
Annotation	Eschweilenol B
Peak:m/z	Relative Intensity
309.2108765	0.89
310.1016235	0.90
311.0490417	2.78
312.6214905	0.88
329.0151978	1.56
347.2780762	0.41
352.1741943	0.63
353.0366211	0.63
378.1825256	0.93
379.1795349	3.42
381.4122009	0.43
382.1349792	0.65
383.9191589	100.00
396.1169128	0.88
396.9566040	0.94
400.9266052	4.47
401.6161804	20.12
406.4553833	0.22
409.7057190	1.53
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
107.9221344	0.72
109.3830414	1.60
127.1787567	1.15
132.8050995	2.15
137.628418	2.17
151.9046631	1.82
153.1142883	1.31
155.0830688	0.67
167.1555786	6.13
173.0009003	0.59
176.9320984	1.88
181.1765594	1.36
185.0210266	1.39
191.5075073	1.21
193.4015961	1.50
199.9151611	1.06
211.1496582	1.33
212.4139709	1.37
213.4849548	0.72
222.0965881	0.49
223.2712402	1.88
224.8691711	0.55
226.2081604	0.92
227.1847229	1.43
229.4194336	1.38
232.3778687	4.33
235.1917114	1.45
235.8436584	1.44
236.8937988	1.22
240.9607849	8.08
247.1495972	1.55
248.7332764	1.05
251.1967163	5.04
252.250824	0.72
253.2188721	4.87
255.5783081	1.05
256.2761841	2.19
265.1688232	4.40
267.0912476	0.98
270.0161743	5.91
273.1377869	3.68
275.2400818	14.84
277.2550354	0.61
279.0654907	0.88
280.4076538	0.43
283.0314331	2.17
291.1766968	0.61
293.2058105	100.00
294.1109619	0.91
299.0527649	2.66
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	551.1767
Annotation	4,6,2',4'-Tetramethoxychalcone 2'-beta-glucoside
Peak:m/z	Relative Intensity
142.9126740	0.12
197.1884766	0.03
222.2321625	0.04
251.3030701	0.07
262.8135681	0.11
295.6995850	0.23
308.3483887	0.03
310.3022766	0.04
313.2817383	9.95
325.2747803	3.79
333.3046875	0.03
343.0662231	39.09
345.2257690	0.02
370.5187378	0.13
389.2203979	0.23
404.6953125	0.05
411.2879028	0.05
417.5136719	0.06
421.2930298	0.03
427.6791382	0.11
429.2690430	0.11
430.5406494	0.06
448.3793945	0.11
463.5969849	0.07
467.2586670	0.11
475.5320435	0.03
476.2891846	0.08
480.7241211	0.02
504.9985352	100.00
505.8506470	0.24
507.3559570	0.02
508.7866211	0.02
515.1128540	0.23
529.8984985	0.10
531.1586914	0.19
532.5494995	0.12
533.5319214	0.20
542.0385132	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	284.2007
Annotation	Levallorphan
Peak:m/z	Relative Intensity
84.2223663	0.19
85.0205536	0.15
86.9254532	0.07
91.0438919	0.56
93.0116501	0.44
93.9826965	1.56
94.9606476	0.62
96.0424194	0.17
97.1011734	0.20
103.1016541	0.17
104.9442749	0.18
105.9375000	0.83
107.0235443	0.81
107.9776764	1.23
109.2172699	0.10
110.1795197	0.14
112.9773407	0.20
113.9498825	0.09
114.9539642	0.27
116.9082184	0.65
118.1319275	0.26
118.9596329	0.49
119.9103699	1.16
121.0782166	0.59
122.0418701	4.98
123.1199341	0.08
124.2002869	0.08
128.1194458	0.14
129.9261780	22.18
131.0245361	1.99
132.1253357	0.63
132.9899597	0.95
134.1217651	2.38
135.0137177	0.48
136.1339722	0.88
137.1138611	0.27
137.9589233	0.05
141.1656952	0.25
142.1261749	0.51
143.0404663	0.84
144.0603638	2.69
145.1994934	1.03
146.0977478	1.80
147.0601654	1.60
148.0846558	1.10
148.9678650	0.32
150.1213684	0.07
152.1258850	0.12
153.1629333	0.46
154.8594666	2.92
156.0264587	29.78
157.0432739	100.00
158.1007996	13.99
159.2471313	2.75
160.1858521	1.40
161.1553040	2.15
162.0328979	1.13
164.1767883	0.43
165.1808319	0.55
167.1325989	1.59
167.9860535	6.88
169.0182953	2.28
170.1504517	8.14
171.0714111	4.75
172.0865479	4.88
173.1117859	1.40
174.1178894	1.69
175.1747589	0.30
176.1871643	5.05
177.2151031	0.67
177.9900818	0.35
180.0639954	1.59
181.0859680	2.15
182.2121887	3.59
183.0203857	3.58
184.0910797	5.83
185.1956940	5.43
186.1194153	16.25
187.1184235	0.97
188.2357788	0.73
189.2843781	0.38
190.2086639	0.76
191.1529236	0.08
193.2424927	0.19
194.2005920	0.72
195.3301086	0.12
196.2929993	0.85
197.1854858	1.20
198.1862183	3.45
199.2305603	10.51
200.1853638	31.90
201.1541443	0.29
204.3229370	0.74
208.1239014	0.26
209.2683411	0.23
210.0838623	0.41
211.1529236	0.25
212.1627808	1.53
213.1024780	2.05
214.3608093	1.33
216.6411438	0.27
218.2570496	0.22
223.8998413	0.23
225.1694641	3.17
226.1957092	1.09
227.1610107	1.29
228.1976929	1.61
229.2919312	0.76
230.5285339	0.17
237.0918884	0.47
239.4594727	0.66
240.3381958	0.46
241.3600464	3.56
242.1991577	17.09
243.2531128	6.33
247.4759827	0.11
254.4125977	5.72
255.6198120	3.20
256.3448181	47.48
257.2716370	0.29
264.5684814	0.15
265.6674805	2.90
266.3804932	9.64
267.3885498	3.10
268.5302124	0.36
269.3952026	1.97
270.4457397	0.51
275.1956787	0.20
282.2358398	1.21
283.3040161	0.24
284.4110718	0.35
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	204.09
Annotation	7a-Epialexaflorine
Peak:m/z	Relative Intensity
60.1146088	2.24
68.1374359	0.30
69.9460678	1.18
79.6265259	0.67
84.0827331	2.01
85.0074158	1.38
95.9616242	11.37
97.0557556	1.47
99.9687042	0.44
102.0321350	1.27
107.9875641	2.28
109.0458832	0.18
109.9442902	2.54
113.9250641	95.12
122.1610107	0.65
124.1405182	0.75
126.0057220	34.92
127.0540314	2.99
137.9912872	22.03
140.0182343	0.34
143.9525909	18.07
145.0499573	4.25
150.0801239	10.23
156.0359802	22.12
158.0378571	38.89
162.1128845	4.10
163.0662384	0.66
167.4641571	6.16
168.0796051	100.00
186.1333771	58.65
187.1085358	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	707.1822
Annotation	Patuletin 3-rhamnoside-7-(3''',4'''-diacetylrhamnoside)
Peak:m/z	Relative Intensity
216.1499023	0.08
322.9389343	0.08
353.1182251	100.00
354.2207642	2.28
402.0881348	0.31
429.2056274	0.07
507.1854858	0.11
515.2658081	0.42
516.3430786	0.13
527.0674438	0.23
534.2841187	0.10
545.5852661	0.29
586.4961548	0.07
593.2673340	0.14
599.1408081	0.25
611.0940552	0.15
627.1345215	0.26
661.4837036	0.12
663.1449585	0.18
671.4873047	0.14
685.2634888	0.07
689.3653564	0.31
699.4129639	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	981.1047
Annotation	Unknow
Peak:m/z	Relative Intensity
318.1158447	0.85
413.3101196	0.53
431.0848083	0.29
461.4960938	0.42
474.3065186	0.47
482.1027222	0.21
500.9679871	1.38
518.2126465	1.56
521.6473389	0.32
589.0812988	0.23
599.3211670	1.19
617.1694336	0.57
685.0836182	0.43
804.6861572	1.26
809.8175049	0.62
816.1567383	0.78
859.0821533	1.09
868.7009277	1.32
879.1860352	0.54
880.2764893	0.71
896.4096680	2.09
916.0494385	0.66
921.0113525	0.41
935.6182861	0.38
937.0554199	3.08
944.0850830	1.08
968.6951904	0.31
1007.8232420	0.26
1010.9902340	1.25
1023.2902830	2.37
1026.1119380	1.58
1051.4116210	1.04
1077.6995850	0.55
1097.2363280	0.98
1102.3999020	1.24
1129.7110600	0.24
1136.8406980	0.13
1145.8922120	0.29
1154.3093260	1.50
1155.5386960	0.96
1163.5627440	10.83
1165.7042240	1.52
1168.6578370	1.04
1188.5095210	1.31
1190.7490230	0.24
1225.8520510	0.62
1246.3758540	3.30
1247.2851560	0.22
1265.7546390	0.83
1284.1253660	2.37
1299.5463870	0.24
1314.6007080	2.29
1331.3060300	1.77
1331.9918210	1.83
1350.7666020	0.63
1352.8416750	0.54
1367.8455810	0.63
1422.8687740	1.19
1430.9436040	0.85
1520.2192380	0.23
1536.1097410	0.18
1604.9548340	0.22
1607.8807370	0.26
1658.2127690	0.34
1677.8602290	0.23
1688.3446040	0.82
1702.6154790	0.31
1739.3049320	0.13
1740.9608150	0.21
1764.9718020	22.94
1779.4141850	0.25
1781.8822020	0.49
1783.4519040	0.20
1784.5096440	0.35
1785.1926270	0.18
1793.1682130	1.03
1796.5111080	0.32
1797.6146240	2.13
1801.0393070	0.29
1806.3470460	1.89
1813.1373290	0.58
1814.5401610	0.21
1831.9490970	0.79
1833.0267330	0.27
1842.3776860	0.39
1850.8145750	0.34
1853.0018310	0.51
1854.3157960	8.83
1856.4289550	0.93
1858.3135990	2.23
1859.1959230	0.13
1862.6629640	0.40
1863.3758540	5.44
1867.8977050	15.24
1870.9167480	19.00
1872.3415530	0.17
1874.9837650	0.77
1875.7545170	0.33
1877.8356930	0.20
1878.7551270	4.47
1879.5804440	5.75
1881.5897220	0.18
1882.4263920	0.63
1891.2938230	7.30
1893.8746340	0.35
1897.4388430	0.16
1904.0964360	0.18
1907.1185300	15.92
1907.8211670	8.06
1911.0793460	0.71
1911.7092290	0.41
1912.7669680	0.27
1915.1297610	1.67
1919.5843510	0.49
1924.6467290	0.24
1926.8781740	4.88
1927.9420170	0.82
1929.1968990	0.90
1930.3145750	9.55
1931.0383300	0.81
1932.5482180	1.51
1933.8323970	1.82
1936.2130130	1.85
1937.2027590	3.66
1937.9901120	1.82
1938.6282960	0.46
1939.7653810	0.69
1942.2247310	2.32
1944.0689700	1.97
1944.7297360	4.94
1946.6896970	2.73
1948.1330570	0.67
1949.7761230	0.24
1951.8596190	0.34
1952.8337400	1.14
1954.1354980	4.42
1955.6253660	0.50
1956.4949950	1.32
1957.7508540	2.30
1960.3228760	2.46
1962.4212650	2.01
1963.7692870	3.37
1964.6483150	2.67
1965.8430180	3.70
1967.5062260	4.70
1968.4381100	1.76
1969.4864500	0.60
1970.8000490	1.87
1972.2990720	1.74
1974.0401610	5.08
1974.7457280	0.84
1975.5946040	2.77
1977.6324460	7.68
1978.5208740	4.23
1979.3726810	2.04
1980.5910640	100.00
1981.2039790	4.99
1982.7672120	48.44
1983.3726810	39.90
1984.2135010	2.19
1984.8585210	0.17
1986.7385250	0.18
1988.0689700	6.17
1989.1066890	6.66
1990.3356930	1.32
1991.4447020	4.65
1992.1437990	0.46
1992.8182370	0.75
1993.9431150	3.03
1995.3807370	0.21
1997.0897220	1.77
1998.1419680	4.34
1999.5921630	9.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	361.1504
Annotation	Gibboside
Peak:m/z	Relative Intensity
112.9308777	0.46
137.1282501	0.53
155.1157837	36.72
156.567688	0.35
161.0031738	0.11
163.0754089	0.39
173.2208252	0.30
174.9638519	0.20
179.9219666	0.32
181.1351471	1.18
182.9324646	0.13
185.0808563	0.12
199.0928192	100.00
200.2045898	4.37
201.2105103	3.82
203.2936096	0.16
231.8793335	0.11
237.2477417	0.33
242.1889954	0.33
243.0058594	0.22
244.1593323	0.14
249.1322021	4.69
255.1731567	0.14
263.572052	0.08
267.1307068	14.97
271.2466736	0.49
272.1508484	0.15
273.1185913	0.08
275.1849976	0.40
285.4597168	0.17
301.1754761	0.53
302.052063	0.16
303.2127075	1.62
316.6949158	0.53
317.3275146	1.64
319.2315979	2.23
320.0286865	0.39
321.1557922	0.66
325.2702637	0.29
327.4124756	0.61
328.049408	0.11
333.3547974	0.13
342.2940369	0.15
343.0589905	0.74
345.0885315	9.45
346.2115173	0.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	402.23
Annotation	Unknow
Peak:m/z	Relative Intensity
165.0449829	0.29
186.9441528	0.98
221.0942383	0.46
223.0274506	3.46
253.0606079	0.25
264.6917419	0.54
270.3028564	0.30
278.7370300	0.63
281.0559387	0.80
289.1379089	0.38
335.7197266	1.02
342.1407776	0.75
366.8914490	1.31
367.5100403	1.51
373.6897583	2.39
385.2273560	100.00
393.1271057	0.73
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	366.2634
Annotation	Unknow
Peak:m/z	Relative Intensity
106.8762817	0.50
114.9487152	0.20
119.2110596	0.85
121.2312622	0.29
133.1375427	0.58
136.9967804	0.44
145.3044434	0.31
146.7371368	1.33
151.2405853	0.09
157.0565643	1.00
158.9967651	0.17
161.0518799	0.25
165.3802185	0.29
175.2419281	0.39
179.4484253	0.33
181.2547913	0.49
189.1288605	16.28
193.1983643	0.28
198.9863739	1.55
207.0535889	16.66
211.2581940	0.22
213.3923035	0.55
215.2337952	0.28
217.1204376	15.99
220.9457092	1.16
235.0596008	100.00
236.2911682	0.81
240.2357788	0.28
245.3299255	0.21
248.3540955	5.07
249.3253784	0.19
266.1175842	78.92
269.4425964	1.72
283.3757935	0.24
286.4052124	0.60
292.2358398	0.18
303.0737915	0.30
306.4137573	0.36
309.5797729	0.25
323.3845520	0.48
331.0862427	0.57
335.0836792	0.20
347.7824707	1.72
348.4289551	0.07
349.4322815	0.38
365.4084473	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	439.1819
Annotation	Unknow
Peak:m/z	Relative Intensity
161.0910034	0.03
162.9262238	1.69
217.0105133	0.16
234.6072693	0.69
235.3590088	0.06
242.2437439	0.19
244.1559143	0.30
255.1413879	0.21
256.0924072	0.14
259.0351257	0.05
264.3565063	0.19
265.1352234	0.48
275.8921814	0.19
276.9939575	0.35
299.3367920	0.16
300.3970947	0.05
306.9570923	0.20
309.3273315	0.05
311.2410583	0.20
317.1467896	0.83
325.0266113	0.19
342.1264343	0.09
347.7171021	0.21
360.3627625	0.10
367.3506775	0.18
375.1315613	0.46
376.2196350	0.44
377.2436829	0.17
380.6382141	0.63
381.2656555	0.06
391.1496887	0.14
393.2510681	100.00
395.2879333	0.20
421.0835876	1.50
421.6845093	0.08
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
160.9218140	0.23
175.0195618	0.02
179.0081482	0.46
221.1009369	0.23
232.6484070	0.09
233.2535553	0.24
250.6130981	0.02
251.2448120	0.01
262.7783508	0.41
263.5427856	0.05
281.0599976	0.27
323.2424927	1.32
341.2580566	0.34
355.3150024	0.01
359.2783203	0.15
365.2568359	0.02
377.3127441	4.07
383.3464355	0.80
424.9604492	0.16
443.0930786	0.48
503.3200073	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	387.1144
Annotation	Unknow
Peak:m/z	Relative Intensity
161.0847168	0.01
179.2332153	0.06
181.1239929	0.00
225.0064697	0.01
266.5030518	0.01
267.2146606	0.01
280.9732971	0.00
323.2545166	0.01
341.2302856	100.00
342.0658569	0.00
344.5029297	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	355.1034
Annotation	Juglanoside E
Peak:m/z	Relative Intensity
134.042511	0.69
149.1373444	1.40
159.9779358	0.30
173.1521454	1.29
174.3306274	1.50
175.0148315	0.20
177.9763489	1.06
179.0924988	0.40
188.7994995	0.28
191.3680725	0.32
193.0544739	100.00
203.1368713	0.25
225.0565796	0.66
233.2431335	0.45
234.1157837	1.46
235.223114	2.37
264.0265503	0.49
275.2914429	0.64
292.3846436	0.19
295.2059326	0.97
297.1856384	0.45
309.0977173	1.47
317.1356201	0.44
319.4839478	0.98
337.3585815	1.01
354.9909363	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	603.0034
Annotation	UDP-D-galactose(2-)
Peak:m/z	Relative Intensity
193.1994934	0.10
211.0653381	1.38
214.9490051	0.46
241.1420288	1.72
256.9852905	0.43
259.1295166	0.17
280.1475220	0.22
283.1925659	0.18
292.9554443	0.06
299.2643433	0.24
311.2201538	0.17
317.1341248	0.05
318.1326904	0.04
323.1268311	43.65
329.0715942	2.77
334.4338989	0.19
339.2905884	0.09
352.1692505	0.20
359.1021729	1.86
361.0515747	0.10
364.3353271	0.07
366.8752441	0.06
370.6572266	0.07
372.0517578	0.06
377.1666870	4.21
378.2188721	0.09
380.0957031	0.38
382.1364136	0.35
391.2281494	0.20
398.2180786	0.07
400.8917847	0.05
402.8139648	0.18
406.2025146	0.08
410.1751709	0.12
414.4647217	0.05
419.0542603	1.63
423.0430298	1.03
424.1625366	0.72
424.8902588	0.30
426.2708130	0.17
428.9489136	3.09
434.7924805	1.03
435.5167236	0.11
440.1569824	0.72
441.1405029	14.79
448.9588013	0.14
452.1005859	0.40
453.1654663	0.11
458.1061401	0.36
462.4332886	0.05
466.8201294	18.50
467.7791748	0.31
470.1343994	6.05
483.0943604	10.54
486.4198608	0.12
488.2749023	0.65
491.0527344	1.19
498.1815796	0.05
500.1266479	0.90
503.8493042	0.10
504.6754761	0.10
506.2908325	0.15
510.7430420	0.02
516.1013794	0.12
516.9270630	0.68
518.7952271	100.00
519.4260864	0.22
524.2477417	0.65
534.7788696	5.65
535.4368286	0.13
542.1593018	0.38
557.1756592	0.04
560.1515503	21.66
560.8710938	0.09
563.7885132	0.23
584.0653687	0.29
585.2362671	11.40
718.7392578	0.05
738.7559204	0.32
742.9822998	0.13
752.6900635	0.17
788.8098755	0.16
904.5775757	0.42
924.7557983	0.05
935.6956177	0.07
972.7770386	0.03
987.7276001	0.04
994.7003784	0.19
1043.0786130	0.09
1076.5825200	0.09
1078.0187990	0.08
1092.6409910	0.33
1335.2492680	0.09
1404.2072750	0.08
1462.5209960	0.18
1568.5233150	0.03
1608.8084720	0.03
1811.6082760	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	786.9314
Annotation	Unknow
Peak:m/z	Relative Intensity
304.5173340	0.53
354.3503418	0.38
364.3272095	0.46
455.1425781	0.30
479.0289917	0.24
511.1071777	1.34
520.8249512	1.19
595.4412231	0.85
610.1456299	1.21
620.9909058	0.52
625.4174194	0.82
643.6464233	0.29
652.4237671	0.43
660.8656006	1.52
681.5177612	0.66
690.7130737	2.52
709.5313110	1.83
710.1984863	1.41
711.1450806	0.38
717.3687744	1.65
723.9289551	0.17
734.8775024	2.23
738.7938843	1.46
741.4425049	2.19
743.9135742	2.50
753.5090332	2.37
756.5057983	2.38
757.4697876	1.77
758.1040649	3.26
760.8209229	4.72
761.5758057	1.07
762.7174683	0.58
764.3737793	3.49
767.1530151	0.89
768.6213379	1.32
769.4040527	0.37
772.8606567	10.97
774.5864868	4.42
775.7468872	9.77
776.7484741	0.80
778.7437134	9.56
795.0930786	3.22
819.5571899	2.36
828.6959839	0.29
833.9281616	0.63
839.3513184	2.51
840.2293091	0.60
864.8048706	1.11
875.4116211	3.16
881.4511108	1.17
882.7577515	1.84
883.9761963	4.11
885.1885376	0.17
887.1911621	0.77
891.4333496	3.63
894.6471558	2.88
898.3458862	0.46
902.2711792	1.60
905.3847656	3.88
907.7555542	3.00
909.0801392	7.52
909.8955078	0.26
911.1652222	3.27
912.2477417	2.16
913.0412598	2.08
914.1770630	4.74
914.9373169	1.34
918.3898315	2.02
920.3913574	4.68
923.1770020	2.89
926.5536499	1.24
933.5825806	6.09
936.2634888	1.78
937.9171753	8.03
939.1730347	3.63
940.9982300	1.15
942.7293091	1.83
945.4453735	5.06
946.5610962	1.77
947.6611938	6.97
951.7031250	3.91
952.9426880	5.03
954.9682617	0.14
956.0148926	2.93
960.6403198	0.99
966.7793579	1.27
1006.3919070	1.99
1015.3816530	2.42
1031.4014890	1.88
1050.8145750	1.28
1059.7540280	2.13
1060.9906010	0.24
1062.5104980	0.71
1065.3848880	1.67
1074.5222170	1.23
1075.2543950	1.65
1090.7380370	0.25
1096.1057130	0.87
1105.6618650	1.84
1118.0231930	0.98
1119.4047850	1.08
1126.7244870	1.02
1129.7346190	1.47
1135.5948490	1.00
1172.3548580	1.12
1176.6990970	0.58
1179.5729980	0.74
1189.2867430	0.87
1213.5327150	0.61
1217.9526370	0.63
1247.2525630	0.33
1453.9852290	0.57
1459.3535160	1.20
1460.3822020	0.19
1552.8641360	0.20
1570.0869140	0.29
1600.8511960	0.34
1623.4910890	0.16
1646.1063230	0.27
1660.1097410	0.21
1692.6442870	0.13
1718.0593260	0.24
1719.2967530	0.31
1739.5949710	0.25
1744.1602780	0.33
1767.5277100	1.24
1769.2623290	0.14
1771.2380370	0.28
1773.3103030	6.67
1779.8890380	0.36
1784.3905030	0.51
1786.6945800	1.75
1788.2464600	1.48
1792.4289550	0.67
1803.4542240	0.23
1806.9230960	0.33
1811.0770260	0.17
1814.5299070	0.60
1823.3215330	1.92
1829.3048100	0.16
1832.0562740	0.92
1832.6605220	0.50
1843.6927490	2.72
1846.0570070	0.58
1850.4339600	0.97
1852.4603270	15.94
1854.2966310	0.17
1855.3172610	0.96
1857.5109860	41.84
1862.2366940	0.22
1863.1251220	0.16
1863.9503170	0.60
1864.9450680	0.44
1869.3914790	0.95
1872.2219240	0.28
1874.4089360	0.57
1878.6566160	0.14
1879.8682860	0.16
1881.5928960	62.12
1884.3065190	0.28
1885.1950680	43.33
1893.7049560	0.25
1895.7634280	3.30
1897.7601320	0.30
1900.6107180	0.49
1902.0755620	0.13
1904.5715330	9.76
1910.9694820	4.84
1913.0554200	2.88
1914.0760500	0.48
1914.9820560	0.30
1917.8573000	0.21
1920.2888180	0.24
1921.1441650	2.85
1925.4097900	6.74
1927.5089110	2.05
1928.1237790	0.21
1933.7497560	1.70
1935.0505370	58.60
1936.7279050	6.60
1938.2580570	0.19
1940.4479980	0.62
1943.4725340	24.13
1944.7366940	1.28
1946.0183110	0.25
1948.2468260	0.30
1949.8449710	0.34
1951.6105960	0.68
1952.5955810	1.95
1953.5152590	6.87
1954.1661380	7.40
1954.7727050	0.85
1956.1291500	5.46
1957.8049320	0.20
1959.2409670	0.40
1961.6051030	6.65
1962.4713130	16.43
1966.2292480	0.14
1967.3428960	8.88
1969.0640870	0.62
1969.9302980	4.01
1971.2415770	22.09
1972.2247310	2.25
1974.3851320	0.25
1976.8328860	2.14
1977.9232180	6.28
1980.8215330	0.49
1982.0494380	0.51
1984.6600340	2.02
1986.5850830	1.60
1987.5350340	0.74
1989.2965090	8.14
1991.4997560	3.46
1992.1380620	100.00
1993.0054930	2.64
1994.0155030	0.21
1994.7535400	20.96
1997.0906980	42.63
1997.9890140	0.24
1999.7780760	1.66
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
140.1756592	0.11
153.0505981	0.07
196.0917358	2.06
200.1796417	0.03
206.2014771	0.07
214.1398621	0.81
219.3438263	0.02
255.2923279	100.00
297.5055847	0.02
338.3400269	0.08
391.2598267	0.27
392.0950012	0.02
405.5433655	0.04
407.6257019	0.07
433.7632751	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	283.263
Annotation	Octadecadiene-1,18-diol
Peak:m/z	Relative Intensity
81.11858368	1.73
82.97451782	1.59
88.70220947	1.01
93.08319092	1.83
94.98249817	6.35
96.93292999	4.24
99.0429306	0.58
100.9521027	14.39
107.0816498	1.79
109.0231018	5.47
111.0410538	1.11
113.0743408	1.99
114.9533997	5.96
120.1064911	0.63
121.0557098	12.18
123.0897827	5.42
124.8600311	0.51
126.6987152	0.78
129.0911407	4.17
130.3174133	0.49
133.0172119	3.06
135.102417	11.49
137.0401306	4.20
139.1724854	3.51
140.9175415	0.23
143.1713257	0.39
147.0582275	1.07
148.9979095	7.12
151.2393646	3.09
154.962204	2.76
156.0276031	0.87
157.073761	1.19
158.8914185	0.42
163.0339661	2.70
164.8919983	7.12
165.5730133	0.40
167.2293701	0.46
169.0201263	2.70
171.0036621	0.52
172.9217682	0.96
177.0706482	1.80
181.0760803	0.77
183.1827545	3.04
184.316864	0.54
185.1555786	0.97
187.1745605	0.20
191.3431549	3.64
195.4849548	0.18
197.342865	0.37
199.2009888	2.35
199.8092957	0.20
200.4522095	0.59
203.4558105	0.57
205.4489746	0.64
207.1877747	0.95
209.232605	2.19
210.8774109	1.37
213.0160828	1.10
219.0292358	1.03
220.9656067	1.94
223.2190552	0.40
225.1339417	19.58
227.166626	3.79
229.0684814	0.77
237.5748901	1.40
239.2533264	5.29
240.2699585	0.66
241.3757019	2.57
242.8028564	0.37
245.3110352	0.82
246.1728821	0.33
247.2345581	41.73
252.0698853	0.92
253.1430664	0.22
255.1824341	1.92
256.3456421	0.81
265.2581787	100.00
266.0560913	0.90
267.5152893	0.93
269.0837402	0.22
283.1983032	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0853
Annotation	2'-Methoxyflavone
Peak:m/z	Relative Intensity
80.98873901	2.04
82.07023621	1.32
94.0819397	2.56
95.06964874	1.81
95.97850037	0.76
97.00958252	1.47
104.9947815	2.04
107.678772	0.40
119.186264	0.88
123.0639496	8.47
124.0062103	3.05
126.1445465	0.95
128.1615448	2.12
129.8908539	7.65
135.3092041	1.12
141.0109558	2.43
143.9309387	0.58
146.9662628	0.83
149.2149811	0.46
151.1006012	45.95
151.9320831	21.73
153.1493378	2.43
155.9098358	1.18
158.1172943	0.88
160.293869	1.12
162.0246124	2.74
163.0013885	0.72
164.2028961	2.49
168.1663971	5.38
170.2825623	4.31
170.9928741	1.44
172.302948	0.77
173.9880371	0.58
176.0299835	15.31
179.3299713	1.19
180.0590668	1.65
183.0908051	1.70
188.2290344	3.83
189.9794464	0.52
191.1239014	0.52
192.160675	1.12
194.1577911	1.99
199.9961395	6.40
205.5165558	1.53
206.1210327	28.22
207.1363525	1.27
208.2173615	5.47
209.5068054	4.78
210.2030487	9.25
211.3870697	2.08
212.2576752	1.08
216.5966797	0.76
218.0529327	25.49
225.2546082	0.58
229.9528656	1.06
230.7343292	0.33
235.2232056	3.83
236.1711578	52.65
236.9546661	0.70
239.1936798	8.35
240.4407806	1.08
245.225174	4.54
252.1536865	1.50
253.0955811	100.00
254.2418823	52.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	426.82
Annotation	Unknow
Peak:m/z	Relative Intensity
122.7981110	0.76
190.8274841	2.93
206.9254913	5.37
212.8980713	0.27
215.0056610	0.56
251.2249756	0.51
253.1514587	0.46
258.9324036	2.33
274.8755798	100.00
290.8203735	58.58
306.3188477	0.38
307.0953979	0.60
318.9594727	0.15
342.7857971	22.03
358.7554321	8.40
366.5399780	0.14
368.8341980	0.25
370.8859253	0.51
380.9626770	0.61
409.0377502	0.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	594.74
Annotation	Unknow
Peak:m/z	Relative Intensity
207.1469269	0.67
274.8406982	1.11
290.7581177	3.73
358.8948364	2.64
376.7484131	0.52
399.0401611	0.20
415.2388306	5.62
426.7916260	10.45
428.8499146	1.94
442.6901245	12.73
458.7336426	2.61
459.4202271	0.53
474.7987061	0.15
487.1279297	0.17
488.8144531	17.56
510.6321411	100.00
511.4312134	0.07
518.8214722	0.15
526.6252441	6.69
530.5650635	0.13
535.0454712	1.22
545.9788818	0.45
548.4793091	13.91
549.1420898	1.74
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	600.7
Annotation	Unknow
Peak:m/z	Relative Intensity
215.0798798	0.09
229.8377075	0.51
264.7079468	0.11
281.0596924	0.08
290.6295776	0.13
323.6358643	0.22
328.0477295	0.24
359.1253662	0.35
364.9630127	2.53
380.8565063	0.64
384.7009277	0.08
388.8212280	0.27
404.9097900	0.05
406.0609741	0.05
421.0378418	0.68
425.1881714	0.13
426.0186157	0.66
427.0016479	0.14
432.7378540	5.02
441.0596924	0.11
448.7287598	10.96
464.7237549	2.26
493.0333862	0.16
493.8568115	0.56
494.7494507	0.32
495.5023193	0.45
499.1755371	0.19
514.7578735	0.17
516.6937256	100.00
517.3258057	0.70
518.3338623	0.35
532.6713257	6.89
539.9580688	0.19
547.7313843	0.23
553.5835571	0.09
554.1844482	0.54
554.9151001	0.10
577.1996460	0.33
590.9735107	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
104.7647095	0.83
107.1382217	0.30
109.0842361	3.54
110.9356537	0.28
119.0140839	0.48
121.163208	1.28
124.8183212	1.02
126.3315582	0.75
132.8531036	0.39
135.0612183	6.87
136.9022217	1.53
141.0845947	0.62
143.051651	2.28
147.0717773	1.42
149.0648499	0.90
151.0966797	1.47
152.8079224	0.41
155.0700684	0.38
156.9849243	1.42
159.0524292	0.24
160.9382935	1.62
163.2708435	0.28
164.0245056	0.37
164.8883972	0.41
169.179718	2.69
171.014267	0.54
173.2166748	2.79
175.0966339	2.70
179.2423706	1.33
183.1325073	1.39
183.9689789	0.45
187.0641479	1.25
189.0363464	0.58
191.2242126	0.86
195.0196381	0.19
197.0333252	0.45
200.9768372	0.37
202.9989014	0.71
205.2174988	3.79
207.29245	0.51
211.1330261	2.72
214.1495361	1.53
215.3018188	0.86
217.3444214	1.93
219.487915	0.74
223.1491699	0.62
225.275238	0.37
229.2329712	0.21
231.0723877	1.33
241.2419128	1.59
242.8740234	0.93
245.4430847	1.74
247.1640015	7.36
251.3900757	0.19
253.0063477	0.58
255.3131104	2.13
259.4262695	0.93
269.1343994	0.32
271.2835693	1.75
277.3257751	3.06
278.2473145	1.54
279.8043518	0.66
281.1411743	1.49
283.1890869	0.97
284.291626	0.25
287.039856	0.93
289.0831299	0.19
295.2057495	1.32
297.4704285	0.69
299.8403625	2.42
305.2245789	2.33
309.1180115	2.27
311.2686462	2.54
313.365448	1.03
315.3904419	0.45
321.0211792	0.32
323.2377319	100.00
324.0986023	0.58
341.1607971	2.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	516.1908
Annotation	Unknow
Peak:m/z	Relative Intensity
172.9573669	7.27
174.0385895	100.00
426.1423950	1.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	285.0617
Annotation	2-Hydroxy-3-(beta-D-xylopyranosyloxy)benzoic acid
Peak:m/z	Relative Intensity
88.73745728	0.12
93.04210663	0.14
105.0223541	0.28
107.9923859	2.75
108.8692932	5.37
121.3406219	0.57
123.0318832	0.68
133.1065063	0.30
135.662384	0.25
139.210022	0.29
149.2827606	0.08
151.1035156	5.53
152.0600739	21.48
153.0268707	100.00
154.0487366	0.19
156.7802429	0.10
161.0587158	0.20
163.1656189	1.74
164.994278	4.77
171.3886566	0.16
175.0049744	0.10
179.0629272	0.32
180.9538574	0.99
183.1122742	0.35
187.2569275	0.09
193.0637512	0.38
195.078064	0.64
197.7905273	0.09
201.3499756	0.16
207.0759888	0.32
211.0701599	0.06
213.1267395	0.36
219.1705322	0.19
220.7689209	0.13
223.2735596	0.12
225.1963196	2.64
227.1047668	0.20
241.1490479	2.17
257.2055359	0.26
258.2908325	0.37
263.3621216	0.20
265.263916	0.14
267.0175171	3.32
267.6784973	0.03
269.3536987	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	217.1584
Annotation	2,3-Dihydroxycuparene
Peak:m/z	Relative Intensity
66.9241409	0.12
68.9303818	0.95
80.9291840	2.17
82.8675995	2.56
91.0104141	0.21
92.9673920	1.98
95.0199432	1.64
97.0843353	0.67
104.7646332	1.90
106.9877319	2.93
109.0470886	2.51
111.0889740	3.00
117.0554199	2.24
119.1109772	21.42
121.0505371	8.06
123.0015106	1.44
125.3235931	0.90
131.0154572	8.94
133.0971832	13.71
134.9128723	2.55
136.9406281	1.00
143.0520782	7.21
145.1185303	19.05
147.0682220	26.20
149.0482941	3.70
155.0332336	0.76
156.9643402	80.89
157.6107330	0.36
159.1470795	23.54
161.0827179	44.82
169.0288086	1.49
171.1762848	18.12
173.1371765	32.01
173.9424286	2.26
175.1022491	86.63
181.0910187	1.08
184.1232758	1.72
187.1207581	0.98
189.0877533	31.64
197.3541870	0.41
199.1859589	100.00
202.3369293	0.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1089
Annotation	5-O-(alpha-Mannosyl)-myo-inositol
Peak:m/z	Relative Intensity
101.0129547	8.43
112.9226456	27.07
114.8960037	2.03
118.8800507	17.80
125.0931702	0.78
130.8586731	7.89
142.9949341	21.68
149.0439758	1.88
161.02771	22.11
163.2412109	1.05
164.1643066	0.86
179.0513306	100.00
186.9416962	1.38
220.3971558	0.69
221.103302	3.03
222.9272766	0.97
225.1736755	1.42
226.2174988	0.53
245.3317261	0.46
248.2272034	1.68
252.5789795	3.21
278.0737305	4.18
281.1073608	3.33
293.0825806	0.83
295.1611328	3.21
296.2228394	1.64
297.2984009	0.55
305.3233643	1.21
308.8490601	0.48
321.1736755	1.68
322.8683472	1.44
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	371.0983
Annotation	Deacetylasperuloside
Peak:m/z	Relative Intensity
111.2484818	0.04
113.0258484	1.77
114.0691528	0.15
114.9526749	0.03
116.0300980	0.03
116.9542847	0.01
121.0480957	2.11
122.1492004	0.28
127.0026245	0.02
129.2593689	0.03
131.1254272	0.02
142.9865723	0.02
147.0159149	0.04
157.0942993	0.10
163.2652283	0.02
166.0659790	0.01
168.7191772	0.02
173.0695496	0.02
175.1266785	0.78
176.5069580	0.02
185.1942139	0.01
187.2371826	0.03
189.1196899	0.15
189.7489471	0.01
193.1257782	0.14
194.1778259	0.01
205.2702026	0.01
206.3515930	0.01
223.3359070	0.12
224.0728149	0.02
225.4296265	0.01
231.1166382	4.71
232.1131592	0.59
239.2103271	0.01
241.2104797	0.01
249.1246643	100.00
250.1155090	10.63
257.2523804	0.02
269.1716919	0.01
277.2210083	0.01
281.4099731	0.01
291.3177185	0.01
295.2490234	0.10
311.2933960	0.35
312.0573425	0.01
313.2549438	0.03
315.1845398	0.00
325.1632996	0.01
325.7778320	0.02
326.4149475	0.01
327.3455505	0.05
328.2822266	0.02
335.1958923	0.10
336.0473328	0.18
337.0769958	0.04
353.1759644	2.92
354.2526550	0.63
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	289.0912
Annotation	Dianthoside
Peak:m/z	Relative Intensity
84.7671967	1.34
96.7829056	10.00
98.9397583	1.82
107.0057068	16.47
108.9224396	23.25
116.8687134	8.14
126.9699478	100.00
133.0977325	2.95
141.2852173	5.10
145.0160522	11.82
147.0818176	2.81
153.0132751	7.80
162.9060211	4.55
165.1870575	1.66
171.1401520	7.45
192.9480591	11.01
197.1926880	5.46
198.9728088	2.46
207.3824463	7.51
210.8603821	19.16
211.4658203	1.39
213.1042480	2.55
223.0893555	5.95
225.0473938	2.86
235.1646423	7.10
240.9416504	17.13
243.2811279	4.83
253.1588745	32.42
261.0063782	16.44
271.0457764	83.40
281.3024597	7.55
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
132.080719	5.48
149.0243073	100.00
150.0172729	30.27
165.8727112	3.47
167.0596619	18.02
167.9772339	8.28
258.2302551	8.08
259.8205566	6.10
261.3476257	6.50
262.2450867	4.20
279.5070496	22.02
280.2792969	7.98
302.2050781	3.64
364.1313477	5.12
385.7301025	11.87
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	359.1346
Annotation	Semperoside
Peak:m/z	Relative Intensity
107.5503159	0.56
135.1650391	0.53
152.9812927	57.56
154.1672974	26.48
156.0666504	0.28
161.106781	1.16
162.1965637	0.82
179.089325	10.89
180.0279236	3.03
190.1824646	0.21
190.9099579	0.37
195.2964783	0.43
197.0890961	100.00
198.1242065	28.76
207.29953	0.25
221.2886963	0.29
228.9884033	2.57
231.0422974	0.25
258.1394653	1.01
267.3718567	0.80
268.1896973	0.30
271.4194336	0.44
272.2189331	3.19
287.9752808	0.64
298.1340332	1.28
300.6531982	0.19
312.3964844	0.30
314.3797302	3.47
315.0610962	4.69
316.2958984	3.79
322.1072998	0.86
324.1637573	0.36
327.2533875	0.53
329.5120239	0.20
340.086853	0.40
341.3622742	4.14
342.3709412	3.25
343.5845642	1.10
344.5138245	1.66
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	902.5005
Annotation	beta1-Tomatidine
Peak:m/z	Relative Intensity
256.7626038	1.02
328.3993225	1.25
354.0527344	1.50
450.2266235	0.46
535.6035767	0.41
556.1765137	1.16
561.5599976	0.26
608.4456177	0.34
648.1000366	1.82
659.8197632	0.46
676.0634766	1.36
677.7864990	0.20
694.8878784	0.62
696.2960815	0.79
737.3087769	0.50
745.6141968	1.18
746.4055786	0.24
753.3419800	0.63
797.2037354	1.16
829.1663208	1.51
881.8244629	1.89
889.4055786	1.58
939.8830566	0.99
948.0018921	0.52
957.0718384	1.63
961.7275391	0.54
965.5386353	1.85
972.0233765	4.84
980.8788452	0.22
985.4660645	2.71
1037.6540530	0.50
1047.3569340	1.46
1061.6896970	0.67
1063.2419430	1.10
1079.0085450	1.03
1118.9914550	4.02
1157.8056640	2.46
1169.7329100	0.75
1279.1315920	0.77
1290.0463870	1.27
1313.5563960	0.82
1332.7630620	0.39
1360.0487060	0.58
1477.0795900	4.49
1538.7675780	1.00
1574.8786620	0.22
1589.9991460	0.33
1590.9869380	0.52
1618.0954590	0.24
1634.2237550	1.07
1638.5648190	0.22
1660.0865480	0.54
1661.3157960	0.46
1661.9265140	0.18
1685.2718510	0.24
1687.2435300	0.31
1708.5150150	0.33
1711.4246830	0.24
1718.7999270	0.22
1731.0949710	2.57
1731.9846190	0.66
1740.9661870	3.63
1743.0515140	0.61
1746.7520750	0.48
1749.5577390	1.54
1751.2263180	2.18
1766.2805180	0.32
1767.4041750	0.26
1768.0095210	0.35
1768.6995850	0.24
1792.8609620	0.50
1796.4803470	1.56
1798.9572750	0.58
1809.4592290	0.69
1811.8848880	0.54
1816.4935300	0.70
1818.2911380	0.41
1821.9725340	0.56
1823.5230710	1.09
1827.1073000	0.28
1827.9113770	0.55
1831.5476070	0.52
1833.0799560	0.29
1834.7664790	0.91
1836.7595210	0.29
1837.6781010	0.61
1838.4743650	1.33
1839.6844480	8.85
1842.1173100	0.56
1846.5318600	0.90
1848.1662600	0.84
1848.8649900	0.24
1850.4969480	1.11
1851.5086670	54.21
1853.9432370	0.37
1855.7308350	1.11
1860.3093260	0.77
1862.4724120	3.48
1863.2232670	1.11
1863.8990480	0.31
1866.3166500	2.12
1867.8546140	0.33
1869.5665280	6.57
1871.8428960	1.77
1872.6080320	0.16
1873.4670410	0.84
1875.0679930	0.24
1875.8597410	2.10
1877.4932860	0.58
1882.8406980	0.29
1888.9021000	1.29
1889.6838380	0.80
1890.5163570	0.55
1892.0745850	0.29
1893.4857180	0.57
1894.4014890	0.33
1896.2790530	0.43
1898.0679930	1.67
1899.2510990	0.67
1899.9371340	1.40
1902.2813720	1.99
1903.0386960	2.29
1903.6744380	3.05
1906.3587650	11.28
1907.8879390	0.43
1908.9255370	1.00
1911.4898680	0.39
1912.4544680	0.28
1913.0643310	0.24
1914.4689940	0.79
1915.7740480	2.97
1917.6398930	1.59
1918.6203610	5.49
1919.5159910	0.64
1920.2845460	0.54
1921.1218260	9.91
1922.1408690	0.58
1924.7635500	2.97
1925.4705810	0.31
1926.1550290	1.86
1927.6668700	0.54
1928.9987790	1.01
1931.0335690	1.16
1932.2473140	0.24
1933.5949710	5.66
1934.8797610	4.19
1936.4509280	0.77
1938.8190920	43.21
1939.7796630	10.60
1940.9725340	0.71
1943.0456540	6.51
1944.3541260	26.70
1945.1378170	0.39
1946.9959720	0.22
1947.8435060	4.43
1949.0889890	7.17
1950.1262210	0.16
1953.0946040	53.91
1954.7288820	7.29
1955.9818120	6.61
1956.6226810	22.32
1957.3843990	30.88
1958.9290770	3.74
1959.8107910	5.88
1961.4055180	0.80
1962.6434330	1.65
1963.5003660	11.30
1965.3814700	3.81
1966.2083740	0.31
1967.5006100	0.68
1968.1080320	5.57
1969.2478030	2.83
1970.6301270	1.66
1971.5538330	2.41
1973.1317140	30.12
1974.0472410	37.67
1975.1696780	21.73
1977.0900880	26.59
1978.7503660	6.08
1979.5076900	19.65
1980.7916260	30.41
1981.8811040	1.76
1982.7718510	3.81
1983.5207520	1.10
1984.4566650	2.32
1985.6905520	1.14
1986.3425290	6.09
1987.5955810	100.00
1988.6710210	1.08
1989.4095460	2.38
1990.7745360	14.39
1991.6696780	0.66
1992.4274900	8.25
1993.3184810	13.38
1994.1750490	5.90
1995.3493650	4.35
1996.2506100	16.92
1997.4250490	0.67
1998.3449710	1.47
1999.3259280	12.96
1999.9595950	1.81
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1091
Annotation	Lactulose
Peak:m/z	Relative Intensity
96.9127045	0.20
99.1759567	0.13
101.0033112	6.81
102.9787750	0.08
106.5320969	0.31
112.9028168	18.23
115.0213623	0.45
118.9332886	14.20
124.9725494	2.74
128.9165039	0.42
130.9197388	8.30
143.0227356	19.65
149.0061035	5.61
161.0166626	22.83
178.9453430	100.00
190.8606567	0.10
208.8662415	0.15
221.1097717	0.28
233.1661377	0.08
235.2457886	0.18
242.1720581	0.03
250.5349731	0.26
251.3821411	0.09
262.8391724	0.11
272.2351074	0.07
277.1322937	0.07
280.9325562	2.83
282.4384460	0.09
293.6816406	0.03
294.9812317	0.30
295.8890991	0.17
297.2752075	0.11
313.0683899	0.11
320.1915283	0.07
323.1323853	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	520.2682
Annotation	PS(18:2(9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
151.0018005	0.19
152.9879456	9.89
161.3666534	0.07
170.4269104	0.07
171.0526428	0.64
178.9586639	0.12
239.8829651	0.25
258.0922852	0.12
259.2999268	0.08
265.3837891	0.04
279.3854980	0.04
297.5105591	0.12
339.4827271	0.16
343.7579346	0.13
391.3359375	0.43
392.4406738	0.28
393.1504517	0.05
410.4967651	0.13
415.5227051	0.05
427.5029297	0.43
430.4502563	0.04
431.4478760	0.05
433.3244019	100.00
434.0158691	0.47
436.2467041	0.06
441.4047852	0.05
446.3397827	0.12
448.2607422	0.32
456.4635010	0.37
457.3146362	0.12
459.6142578	0.33
461.5223999	0.13
462.8779907	0.10
463.6295776	0.04
474.2493286	0.21
476.8552856	0.65
482.1552124	0.87
484.1535645	0.97
491.9126587	0.08
499.4220581	0.17
501.5328979	0.77
502.3453979	0.49
503.7301636	0.40
505.2184448	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	694.68
Annotation	Unknow
Peak:m/z	Relative Intensity
290.6326904	3.20
358.8099365	3.61
374.9877319	0.31
441.0103760	0.45
442.6596069	15.90
457.7100220	0.51
458.7772217	16.50
526.6171875	100.00
542.0482788	7.86
542.6981812	88.61
556.6606445	0.94
588.0932617	3.14
588.7998657	3.34
596.3527222	2.06
608.5057983	1.77
609.9570923	10.23
610.5900269	78.21
611.2378540	1.86
626.6109619	1.92
628.7509155	0.51
634.7276611	0.51
647.5385742	0.54
648.7788696	10.31
660.6715698	0.62
671.1762085	3.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	583.2029
Annotation	Sylvestroside IV
Peak:m/z	Relative Intensity
164.1721497	0.05
164.9743500	0.19
179.1733398	0.27
195.1413422	1.22
327.3214111	11.55
328.3972778	0.41
356.9959717	0.18
358.0239258	0.01
375.1422729	100.00
376.2634277	2.12
385.2164917	0.04
416.2784424	0.02
417.3171387	0.09
459.1983032	0.52
476.7713623	0.07
489.4802246	0.06
505.1537476	0.08
507.2951660	0.04
518.9896851	0.12
536.3636475	6.45
536.9699097	25.85
537.9594116	0.73
538.9857788	0.04
539.6593628	0.02
548.1266479	0.02
563.5053711	0.02
584.1538696	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	310.09
Annotation	Inodxyl glucuronide
Peak:m/z	Relative Intensity
103.8374634	0.13
118.7999039	0.54
134.9808350	0.19
137.0519867	0.17
144.9779968	0.43
163.2518921	0.19
166.2330933	0.34
171.8771973	0.32
174.6648254	0.49
176.9859924	100.00
177.9840088	0.12
179.0938568	0.32
196.0626526	0.27
207.2406311	0.31
209.0738831	0.37
220.1413269	0.86
236.4039917	0.23
237.2102966	0.43
243.5443726	0.31
247.1250000	0.66
250.3671265	0.11
251.1279907	0.47
255.1460876	0.24
264.1009827	0.28
266.2051392	0.41
269.0935059	0.72
273.4944153	0.28
274.3083496	0.41
275.0271606	0.34
279.3056641	0.15
282.1127625	0.13
286.8355713	0.59
288.9675903	0.44
291.3067627	1.58
292.0665283	2.10
293.2988892	0.17
294.3742676	0.13
300.6713867	0.82
309.2200623	0.45
310.1390381	0.72
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.0715
Annotation	7-Hydroxy-3-Methylflavone
Peak:m/z	Relative Intensity
82.97993469	6.63
97.04701233	7.68
99.10708618	3.33
100.1816406	2.73
125.0718231	3.48
133.2401276	3.88
136.7315216	4.24
139.1471252	11.15
145.3579102	12.12
149.0443878	4.17
149.9878387	5.60
166.0647888	2.78
166.9476624	2.09
169.2516632	4.08
176.8527222	7.51
179.0531158	3.63
181.0462646	3.08
183.1280365	12.74
190.9643402	7.30
195.191803	16.75
204.7006378	14.13
206.2585907	7.11
207.1859283	71.60
208.2964935	7.48
209.1507416	62.03
222.0574188	12.18
223.0331116	45.15
232.3678741	18.33
232.9914551	12.01
234.7675018	2.29
251.0764771	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	281.14
Annotation	(+)-Cheimonophyllal
Peak:m/z	Relative Intensity
83.2546539	0.03
87.0016403	0.02
94.9400940	0.22
96.9821472	0.03
101.0931702	0.06
105.0067444	0.03
107.1488190	0.07
111.0122375	0.31
118.9546204	0.27
121.0161362	0.17
123.1043243	4.64
133.0628967	0.53
134.8650208	0.06
136.9468842	0.15
138.2537537	0.05
139.0657349	0.23
143.1433716	0.09
145.2445679	0.52
149.2845154	0.08
151.2064362	0.12
153.0611572	1.07
154.8458862	0.08
156.2645264	0.02
159.1311493	0.38
167.1039734	0.06
169.1047974	0.10
171.1295776	10.85
175.0518646	0.31
177.1239166	0.03
178.2236176	0.06
181.1324463	0.03
183.3135376	0.07
189.1699829	4.56
191.2182922	0.07
193.1343384	37.86
195.3871460	0.08
199.7468262	0.19
201.0526428	4.16
205.1358948	0.15
207.1610718	5.60
209.1860962	0.13
216.8779297	0.03
219.0568848	10.38
221.1789856	0.19
223.1844788	0.16
235.2184448	1.08
237.2301636	100.00
239.0906982	0.05
244.9890137	0.07
252.1690979	0.03
253.1408081	0.04
254.6003418	0.09
260.9878235	0.09
261.8012390	0.05
263.2393799	0.37
266.9387817	0.07
280.8526306	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
108.932869	2.03
121.067215	0.44
122.8823929	0.47
132.9654236	0.76
135.1023712	5.92
137.1022644	0.75
141.0578308	0.97
145.0033875	2.50
146.8866425	1.02
149.2368774	1.24
151.2916412	0.55
153.8081512	1.13
155.0796204	0.30
157.0086365	0.71
159.0169983	0.85
161.1906738	0.83
163.2011566	1.50
165.0970459	2.10
167.0820007	0.32
169.0216675	0.38
171.2962799	0.33
175.0181274	2.25
176.9227905	0.27
179.3002319	0.68
182.9436493	3.82
187.1474609	1.80
189.1704407	0.52
197.0235291	0.38
203.1750031	0.39
206.8947296	1.15
211.0249939	2.36
215.2998047	0.63
217.26474	0.63
219.390625	0.87
222.9039307	1.49
231.3378906	1.66
243.1859131	1.47
247.3763428	7.05
249.1618958	0.70
250.1304321	0.27
253.3765259	2.95
255.4231567	0.84
257.3624573	0.22
259.2453613	0.88
265.4060974	0.86
266.2547607	0.84
269.4128418	0.88
271.2374268	0.70
279.1729126	1.71
281.333313	0.43
282.1783447	0.70
283.0151978	0.90
285.0913391	0.74
287.258667	0.83
287.8671265	0.40
295.3492737	2.02
297.102478	2.66
299.3153687	5.10
302.8113403	0.48
305.2998657	2.56
308.7236633	1.08
311.2047119	1.27
313.1370239	0.35
317.437561	0.79
323.2452087	100.00
324.4180298	0.38
327.368042	1.32
341.0702515	0.64
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	937.26
Annotation	Unknow
Peak:m/z	Relative Intensity
428.9298096	0.23
452.6676636	0.89
544.2363281	0.30
657.2234497	0.46
688.1824341	0.27
689.4734497	0.35
897.7460938	3.00
975.2774048	7.92
1007.4920040	0.69
1035.9108890	1.13
1065.5395510	0.34
1352.2503660	0.41
1585.6491700	0.15
1611.4283450	0.13
1629.5538330	0.10
1638.3421630	0.11
1642.0037840	0.23
1666.3640140	0.29
1697.1848140	0.09
1698.1744380	0.47
1713.6510010	0.18
1724.7183840	2.62
1735.2825930	0.36
1751.4855960	1.66
1777.0670170	0.18
1781.3529050	1.38
1783.4071040	0.23
1784.8967290	1.65
1797.9647220	0.54
1802.1027830	0.57
1804.7180180	0.25
1815.5155030	0.18
1818.0593260	4.70
1821.4044190	0.32
1824.4710690	0.29
1826.4449460	3.20
1827.2418210	0.43
1830.0040280	0.19
1842.1624760	0.17
1848.5528560	0.21
1850.2810060	3.56
1861.5129390	0.58
1863.4304200	0.13
1864.6817630	6.79
1866.3021240	0.28
1867.1910400	0.45
1868.0531010	0.40
1869.1956790	0.12
1869.9388430	0.21
1871.8605960	0.10
1874.3536380	0.92
1875.5860600	0.09
1877.1306150	3.19
1879.5526120	0.19
1880.5274660	0.95
1884.6314700	0.16
1888.0803220	1.30
1890.8513180	0.29
1892.2824710	2.39
1894.8371580	0.30
1896.5850830	0.84
1897.8165280	0.64
1899.0515140	0.17
1900.1076660	0.12
1901.3026120	0.24
1904.4198000	0.15
1905.3020020	0.32
1907.1926270	0.19
1908.5245360	0.15
1909.8454590	6.95
1910.5069580	0.23
1912.6251220	0.13
1916.9324950	1.53
1919.3640140	2.69
1921.1375730	0.44
1921.8596190	6.79
1923.0716550	1.09
1928.7487790	0.13
1929.7789310	1.21
1930.9958500	0.21
1932.5760500	0.17
1933.7486570	0.11
1938.2091060	0.19
1940.7205810	0.87
1941.7253420	0.76
1943.8552250	0.18
1945.3253170	0.31
1946.2877200	0.63
1947.1394040	0.36
1948.1770020	2.70
1949.4832760	3.70
1951.5964360	13.31
1952.3723140	5.80
1953.4924320	0.23
1954.4998780	0.59
1957.8787840	2.02
1961.0983890	0.17
1962.9818120	0.17
1963.9987790	5.90
1965.1444090	4.42
1965.9523930	0.99
1966.7316890	30.11
1968.1624760	0.75
1968.8669430	0.20
1970.2913820	1.40
1971.5124510	15.73
1973.5745850	0.17
1974.8924560	17.16
1977.1907960	13.81
1978.1529540	0.66
1978.9356690	6.11
1980.1467290	100.00
1981.4764400	0.82
1983.2711180	0.62
1985.5465090	15.35
1987.6195070	2.36
1988.7435300	68.15
1990.1326900	2.96
1991.0775150	0.35
1991.7640380	0.16
1992.5675050	7.68
1993.8336180	0.31
1996.1959230	0.18
1996.9134520	19.64
1998.5084230	8.60
1999.3927000	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	597.1764
Annotation	Isoreptanthrin
Peak:m/z	Relative Intensity
213.3981628	0.07
274.9601440	0.04
292.2333374	0.18
295.0064087	0.35
295.6067810	0.03
307.2274475	0.71
308.1129761	0.04
309.0805664	0.41
310.1768494	0.37
321.2805786	0.57
322.3978882	0.08
400.2229614	0.03
415.2975464	30.24
416.3040161	7.81
427.4094849	0.14
428.3558960	0.05
459.2391357	100.00
460.2663574	21.14
502.3482056	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	551.1768
Annotation	Lactucaside
Peak:m/z	Relative Intensity
208.9082642	0.09
231.3420410	0.05
295.3716431	0.14
306.2108765	0.07
311.1044312	0.08
313.2873535	9.35
315.4516602	0.08
325.1819458	2.72
340.4780884	0.09
343.0567017	37.19
353.4776611	0.34
357.4288330	0.09
359.4572144	0.16
370.2299805	0.34
375.6036987	0.08
388.5853882	0.21
389.2955322	0.68
396.0152588	0.06
397.3665771	0.21
413.3987427	0.08
414.9932251	0.05
425.4940796	0.05
427.4882202	0.33
435.4187012	0.05
436.4793701	0.08
454.3583374	0.31
455.1159058	0.14
461.0941772	0.06
463.6250610	0.05
466.4617920	0.05
475.0381470	0.22
487.3024292	0.08
488.0628052	0.10
491.5608521	0.15
496.2020874	0.04
505.0047607	100.00
505.6881714	0.74
507.3734131	0.04
509.4165649	0.05
515.6301270	0.22
531.4065552	0.12
533.5606079	0.51
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	402.9172
Annotation	Unknow
Peak:m/z	Relative Intensity
130.7865906	0.04
159.1646881	0.12
175.0240173	0.57
195.9542542	0.02
245.1162720	0.16
246.0448914	0.02
261.0239258	0.05
272.9826660	4.02
287.2080688	0.08
288.9570312	100.00
314.1672058	0.02
329.2313843	0.02
330.1732788	0.01
346.9610901	0.02
356.0222168	0.40
356.9339294	0.14
357.5451355	0.02
358.5038147	0.08
359.2503357	0.16
373.8153992	0.15
375.4701538	0.02
385.0200806	0.03
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
95.03053284	0.94
111.1620636	1.29
123.2676544	0.92
125.128952	3.72
139.2196045	1.49
143.1273346	0.69
147.0801392	0.59
153.1186218	1.79
155.1522064	1.01
157.144989	0.98
163.1822662	2.69
164.2036438	2.26
168.9267578	1.94
173.1138763	3.74
181.1231995	0.69
182.9337769	2.60
190.4468079	2.16
191.1791992	4.71
193.1535034	0.52
194.9362793	2.41
197.3748169	0.58
199.2417908	5.39
201.3683319	1.17
205.1463318	0.98
206.0698242	1.76
207.1465149	1.09
211.3868103	7.02
213.3172913	1.32
221.2288818	1.50
227.4240723	3.73
230.5116882	3.79
231.2145996	0.83
237.5176086	0.75
241.1282959	6.05
247.2205811	2.08
251.2697754	10.14
253.0073242	6.20
257.0862427	2.37
263.3018188	1.51
264.0565796	0.46
265.2526245	4.16
267.5083008	7.47
268.5623779	1.73
269.3189697	6.96
270.1533508	3.80
271.8676147	1.20
275.255127	17.49
277.1340332	0.95
282.6898804	2.46
283.4163208	8.75
287.1636963	0.41
291.1947632	0.69
293.2058105	100.00
293.8373413	0.51
303.0101013	4.48
310.3469238	2.78
317.9257507	2.52
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
121.3372192	1.73
124.9863358	3.43
134.9791565	6.69
151.3170624	0.98
156.848175	2.34
158.9866791	1.71
161.0905151	5.12
167.1930847	1.26
168.9378967	1.47
173.0571899	3.89
174.7870178	0.82
177.344223	1.22
182.2726746	0.64
183.2311554	0.64
187.3655701	0.36
189.1214752	0.59
193.2065582	0.64
197.2114868	1.81
205.3056488	2.08
209.0961914	1.49
215.1560669	1.54
216.9747314	1.87
223.5276794	1.93
227.1390686	1.08
237.4133301	1.28
247.3117371	3.74
253.0847473	0.82
256.2657471	2.90
267.3076782	2.32
283.1912842	4.56
285.308197	0.86
287.1974792	0.64
299.0787659	1.36
299.6897888	2.79
305.2804565	1.96
309.3366089	1.05
321.5360718	2.09
323.2464905	100.00
323.8630371	2.05
341.3183899	1.98
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	730.7181
Annotation	Unknow
Peak:m/z	Relative Intensity
216.3172302	3.83
290.6439819	1.67
410.8477783	5.21
426.8483887	4.81
442.6204834	4.91
478.8825073	0.85
494.7233887	35.04
510.7427979	7.38
526.8565674	3.03
548.0281372	1.76
562.5101929	10.77
563.1262817	4.61
564.6492310	1.57
569.0783691	3.51
578.5851440	75.33
586.7550049	1.92
594.7015991	17.95
597.6892090	3.93
615.7012329	0.78
646.6184692	100.00
661.9605103	4.77
662.8865356	8.39
683.8612061	7.19
684.6731567	2.44
695.1201172	1.55
696.5344238	2.36
706.9083252	3.54
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	163.06
Annotation	1,6-Anhydro-beta-D-glucopyranose
Peak:m/z	Relative Intensity
72.90840912	6.70
84.93013	9.07
88.88256073	5.48
89.56612396	2.17
90.68267822	6.98
96.89031982	4.14
98.89401245	1.07
100.4677277	3.38
101.0682831	3.61
102.2266083	3.90
106.9043121	61.18
114.8471375	7.83
116.9259644	56.41
120.9010315	2.02
126.9842377	14.33
133.4997101	1.07
134.9130249	10.40
142.1996307	8.32
145.0478668	100.00
146.5817719	1.94
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2418
Annotation	Moniliforminol A
Peak:m/z	Relative Intensity
95.04114532	0.43
96.7625351	2.25
118.9818268	0.86
123.1009064	6.91
127.0714874	1.40
136.8045044	3.21
138.9414368	0.71
142.9610901	2.18
149.1798706	0.90
151.113678	1.15
153.2072449	0.53
154.8260498	1.44
159.0758057	0.69
161.0488281	0.79
165.1586914	4.51
171.1361542	2.57
173.0513306	0.43
175.1238708	0.48
180.9849548	2.50
183.0735168	3.35
197.0906219	6.39
198.9455566	4.47
207.1143188	1.67
209.0916748	0.70
211.1271362	1.06
219.2794189	0.97
221.3746643	1.44
225.2026062	1.19
230.9961853	0.81
233.0039368	2.13
237.2956238	4.29
239.1998596	8.87
256.2879944	0.62
259.3167114	2.62
261.1268616	3.06
266.3184814	2.44
269.2781372	1.27
278.1569824	1.79
279.2398071	100.00
281.3760681	0.76
288.3930359	0.95
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	448.76
Annotation	Unknow
Peak:m/z	Relative Intensity
194.9031067	0.36
235.1709290	0.30
236.2553558	1.12
237.0715332	0.25
251.1009827	0.90
294.7781982	0.29
297.2088623	0.24
310.3632812	0.25
320.3070068	0.91
350.7614746	0.38
364.9176331	10.87
380.3608093	0.30
402.8473206	100.00
406.1177673	0.62
430.8210754	1.68
448.9668884	1.54
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	207.174
Annotation	15-Nor-2-acoren-4-one
Peak:m/z	Relative Intensity
70.8079071	0.38
72.8055038	0.10
78.6704636	0.15
81.0027161	1.37
83.0351105	0.13
86.8952789	0.11
89.0682602	0.49
93.0025177	0.38
95.0175629	0.97
97.0862122	0.07
99.0005951	0.16
104.8333740	0.48
107.0474854	0.42
108.9085846	0.79
110.9748993	0.14
119.0292511	6.46
121.0070496	4.20
123.1594696	0.97
125.0928345	0.52
127.0887299	0.26
130.6700745	0.20
133.0996246	5.73
135.0905304	0.81
137.1226044	0.62
145.1874847	1.00
147.1104279	4.08
149.1248322	10.31
151.1469879	3.86
157.1594391	0.10
161.1397705	1.24
163.1802063	0.89
165.0701752	0.72
166.0873566	0.12
171.2557220	0.24
177.2929535	0.06
179.1672363	2.10
182.6904297	0.07
189.1106415	100.00
190.1769104	0.04
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
158.9934387	2.98
160.0033112	0.59
161.0279541	0.96
162.1723633	0.07
199.0683289	0.08
200.4592285	0.10
201.1466522	0.42
202.2386475	0.06
216.9719543	0.07
218.1357422	0.09
220.1491699	0.05
229.0627441	0.46
230.0468445	0.08
231.0107880	0.25
245.1353455	0.03
272.9944763	29.38
274.0704651	17.53
275.0195007	33.96
276.1056213	4.96
346.0744019	0.07
374.2151489	0.07
387.0142517	27.29
388.0178223	22.96
388.9561462	100.00
390.0380859	30.72
429.0398865	0.33
431.0941772	0.06
457.1554871	0.10
459.0781555	1.88
512.0707397	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	519.1718
Annotation	Coelovirin A
Peak:m/z	Relative Intensity
178.0296021	0.18
191.1202240	0.23
222.1625671	0.04
233.2140656	0.76
253.2716064	0.06
293.1395264	43.54
301.1159058	0.07
329.2500000	0.05
341.3215332	0.19
388.0617065	0.09
399.2844849	0.39
413.4479370	0.27
429.4773560	0.14
457.3229980	0.21
473.1388550	100.00
474.9174194	0.08
481.2265015	0.40
483.5230713	0.30
499.4815674	0.26
501.4163208	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	942.7562
Annotation	Unknow
Peak:m/z	Relative Intensity
299.0940247	0.27
301.2578125	0.33
317.8666077	0.38
324.1019897	0.57
346.6761475	0.15
363.4322815	0.42
369.3863831	0.34
370.1404419	0.33
387.1398926	0.41
405.0412598	0.67
418.1348877	0.19
431.2359009	0.33
481.7524414	0.28
483.3863525	0.45
493.0935059	0.27
500.1092529	0.92
501.4694214	0.50
518.4093018	0.59
519.0183105	0.05
521.3807983	0.08
571.4450073	0.12
599.4205933	0.22
600.3485718	0.60
607.3786621	0.30
616.3541870	0.26
623.1234131	0.22
676.5727539	0.05
677.5109863	0.63
678.5504761	0.30
685.1217651	0.39
688.4761963	0.20
694.6144409	0.85
695.7182617	0.16
706.1259155	0.87
714.4680786	0.40
729.0198364	0.04
732.1480103	0.11
738.0241699	0.23
740.5376587	0.83
744.5826416	0.51
745.6548462	0.91
746.3638306	0.20
753.9200439	0.85
754.6008911	0.22
755.4281616	0.37
758.4653931	0.20
763.8503418	0.34
767.4827271	0.46
777.5294189	0.41
781.6066895	0.86
782.5963745	0.38
795.6480103	0.79
799.7244263	0.40
800.3897705	0.68
806.1505737	0.47
806.8585815	0.15
807.6245728	0.32
812.0692139	0.56
813.3359375	0.12
814.6126099	0.39
821.7805786	0.71
822.3884888	0.22
826.3908081	0.39
831.8678589	0.74
833.9273682	0.28
836.2675781	0.16
837.8024292	0.67
840.6352539	0.13
841.4834595	0.38
845.0448608	0.07
850.7077026	1.75
862.6336670	0.09
864.2093506	0.55
869.1445923	0.92
876.1131592	0.55
877.4789429	0.55
879.1506958	0.56
880.2522583	0.12
882.5371094	2.37
884.0204468	0.23
888.1504517	1.06
888.8575439	1.31
891.3215942	0.34
892.6920776	0.64
905.6561890	1.76
908.2782593	0.26
910.5604858	1.23
911.5563354	1.01
913.8016968	0.34
924.5297852	0.91
925.4888306	0.34
929.1627808	0.13
934.1930542	0.28
993.5768433	0.36
994.5512085	1.01
1002.3074340	0.12
1008.9245000	0.25
1010.7355350	0.50
1014.7427370	1.14
1015.9660640	0.37
1023.5231930	2.71
1024.4956050	1.29
1026.9533690	0.24
1033.7535400	0.35
1035.8944090	0.18
1042.0125730	0.16
1048.8945310	0.31
1049.5341800	0.20
1054.9626460	0.20
1058.7691650	0.13
1066.4062500	0.21
1067.8730470	0.24
1073.6947020	1.18
1074.8321530	0.74
1083.6459960	0.11
1097.3182370	2.97
1098.2548830	0.48
1105.9495850	10.62
1106.9171140	8.26
1111.4598390	0.25
1116.9345700	0.56
1121.9733890	0.24
1137.8183590	0.40
1147.9268800	0.10
1150.0493160	0.17
1155.3940430	0.71
1159.7755130	0.58
1164.8553470	0.15
1165.5781250	0.25
1166.9265140	0.30
1168.7032470	0.52
1175.6905520	0.19
1194.4318850	0.38
1199.3430180	0.90
1200.0540770	0.23
1202.8898930	0.54
1203.6884770	0.28
1223.5319820	0.13
1225.8209230	0.40
1246.7280270	0.32
1253.8413090	0.38
1256.9040530	0.46
1257.5178220	0.33
1266.4763180	0.36
1275.4431150	0.10
1277.5650630	0.14
1294.8841550	0.62
1296.2852780	0.31
1296.8946530	0.24
1297.7928470	0.15
1300.9921880	0.48
1302.9783940	0.08
1303.9254150	0.39
1305.2100830	0.22
1306.8355710	0.10
1312.7631840	0.14
1314.7675780	0.44
1318.7452390	0.57
1320.3645020	0.14
1331.6636960	0.25
1332.5635990	0.39
1342.2414550	0.21
1349.4250490	0.16
1356.7171630	0.07
1359.0032960	0.34
1387.1632080	0.17
1406.2700200	0.24
1406.9079590	0.21
1407.8790280	0.10
1422.4820560	0.10
1430.0361330	0.41
1431.2447510	0.17
1478.7219240	0.10
1497.4699710	0.07
1517.8717040	0.15
1538.8859860	0.15
1553.3800050	0.11
1570.0152590	0.06
1576.6026610	0.07
1623.1926270	0.07
1660.6756590	0.07
1663.1353760	0.38
1689.4241940	0.25
1695.8186040	0.07
1715.9747310	0.15
1726.2547610	0.08
1728.3570560	1.65
1732.8162840	0.28
1752.8133540	0.09
1757.6247560	0.34
1785.7342530	0.13
1786.9055180	0.22
1798.5777590	2.38
1806.3284910	0.07
1809.3692630	0.26
1819.1037600	0.17
1823.3834230	0.17
1824.6480710	0.15
1826.0070800	0.90
1828.4862060	0.19
1838.0198970	0.64
1849.0250240	0.11
1852.4205320	0.12
1859.6292720	0.16
1862.8107910	1.06
1867.1722410	2.11
1871.2774660	0.21
1875.1364750	0.13
1881.8082280	0.11
1882.5451660	0.08
1883.5914310	0.28
1884.8455810	2.97
1888.0187990	0.32
1893.8231200	0.08
1896.8385010	0.18
1897.4559330	0.76
1900.7613530	0.08
1903.2858890	0.08
1905.6827390	0.10
1911.1834720	0.15
1911.8272710	0.07
1912.7224120	0.13
1913.9146730	0.21
1917.9704590	0.11
1920.0964360	2.19
1920.9061280	0.29
1924.2498780	0.22
1926.1163330	0.10
1926.7307130	0.40
1928.2269290	0.06
1930.5750730	0.04
1932.7921140	5.93
1935.2652590	0.39
1936.6553960	11.31
1938.6134030	0.08
1939.4826660	0.46
1940.2473140	0.08
1941.1573490	0.33
1941.7767330	0.21
1944.4627690	0.67
1946.0826420	1.43
1946.8055420	0.11
1948.6636960	0.13
1949.6617430	0.07
1953.9468990	0.55
1954.6492920	0.23
1956.1119380	0.40
1957.9879150	8.52
1958.9841310	0.40
1959.9246830	0.14
1960.9854740	1.89
1961.7794190	1.49
1962.6717530	3.17
1963.9202880	0.09
1965.6760250	0.06
1967.2982180	0.13
1968.3015140	0.47
1969.1619870	61.59
1970.9163820	3.71
1972.4041750	0.33
1973.8580320	0.09
1974.5314940	0.11
1975.9040530	0.47
1977.3377690	1.70
1978.5701900	7.51
1979.7484130	0.56
1981.1920170	0.34
1981.9260250	1.08
1983.2054440	0.74
1984.0645750	0.14
1985.8029790	0.80
1987.4992680	3.22
1988.5540770	0.08
1989.6384280	0.20
1990.3475340	59.46
1991.9022220	3.87
1993.0367430	0.32
1995.2312010	17.59
1996.7790530	34.96
1997.6055910	0.48
1999.2923580	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	516.74
Annotation	Unknow
Peak:m/z	Relative Intensity
235.1509399	0.51
280.9162598	0.56
296.8517456	1.34
323.2332764	0.57
323.8873291	0.55
338.8815308	0.21
342.4530640	0.94
348.9791260	5.14
358.8239746	0.53
361.4804077	0.55
364.9487915	30.25
380.1015015	1.96
380.7815552	8.83
408.2228394	0.43
432.8386841	100.00
448.6992188	22.34
498.1304321	6.19
499.2817993	0.47
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	329.0876
Annotation	Phaseoloidin
Peak:m/z	Relative Intensity
107.9541473	0.95
123.0669022	1.03
125.0810699	0.16
150.1488800	0.18
152.0500183	3.79
161.0896301	0.16
165.9322205	0.29
167.0123291	100.00
173.0186157	0.23
197.1231079	0.08
198.4629364	0.09
203.6943207	0.06
209.0997620	0.41
213.5082397	0.12
215.1481323	0.15
229.1295166	0.10
231.8701782	0.07
233.1474304	0.35
237.3332214	0.17
241.1071167	0.08
245.0343323	0.08
257.2982788	0.08
267.1346741	0.23
269.2236328	0.21
271.9830933	0.14
280.7258301	0.05
282.8545532	1.78
285.1799316	0.14
291.2529907	0.14
293.2274170	3.92
299.5473633	0.06
310.6481018	0.56
311.4909058	0.38
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	762.67
Annotation	Cer(t20:0/26:0)
Peak:m/z	Relative Intensity
259.5399475	0.18
274.7686768	0.38
290.8905334	1.49
358.8167114	1.24
375.0811157	0.26
426.6672974	1.10
438.7377930	0.25
442.6789551	10.16
458.9942627	1.69
510.7753906	16.09
526.5333862	30.64
527.3038330	0.79
532.8490601	0.24
542.7269897	3.15
561.9979858	0.77
594.5384521	25.21
595.2034302	1.51
596.8140259	1.02
610.0968628	11.45
610.7968140	14.31
625.0075684	0.30
626.3428345	1.23
630.7500610	0.55
632.8552856	1.59
640.4298096	0.15
654.5416260	0.27
656.6738281	0.46
678.5054932	100.00
679.2606812	0.30
681.8629761	0.71
694.6452637	1.17
697.2658691	0.73
716.2232056	1.20
716.8703613	1.86
746.2290649	0.27
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
113.0129471	0.10
127.1674652	0.12
135.2497559	0.04
148.9261932	0.08
163.1440430	0.12
165.0099945	0.12
174.9565125	0.17
177.0522156	0.03
185.3438110	0.07
191.2100525	0.04
193.1726379	0.05
205.2046814	0.17
217.2609863	0.06
223.3988037	0.04
230.8824158	0.15
235.1575623	0.02
249.0777283	8.49
264.1497498	0.09
267.1479492	100.00
269.3565369	0.07
272.0599670	0.05
280.7934875	0.02
289.0817261	0.38
293.2168884	0.12
295.4245911	0.13
311.3651733	0.14
313.4215393	0.08
320.9974976	0.21
322.0559998	0.04
323.4158630	0.09
325.2871704	0.95
331.1604614	0.06
339.1594543	0.36
340.4328003	0.05
341.3444519	0.28
348.2467041	0.15
349.3633423	0.10
351.1559143	0.14
354.3780823	0.14
355.3381958	0.11
357.0871277	0.17
365.6344604	0.16
367.2734680	0.88
369.3990173	0.04
370.2050476	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	322.076
Annotation	Beta-Citryl-L-glutamic acid
Peak:m/z	Relative Intensity
102.0141296	0.19
110.9293518	0.15
118.2406998	0.42
121.9916534	0.10
129.9407196	100.00
147.8803406	0.08
157.7123413	0.10
175.0208588	0.09
175.9290161	1.03
182.6937561	0.38
184.7602081	0.10
193.0860596	5.61
208.2752380	0.21
210.1706238	0.10
225.7471313	0.08
232.0094299	0.13
233.2418213	0.90
247.1040649	0.62
259.2604980	0.09
285.1887512	0.21
288.3336182	0.15
303.2075195	0.14
304.1557007	0.89
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
92.92350769	0.26
94.88659668	0.15
97.0436554	0.38
99.04013062	0.20
112.9457397	0.39
118.9162827	0.17
122.9585953	0.89
125.0339737	1.48
127.0443192	0.24
135.1529694	0.47
136.934845	0.28
138.9920807	0.55
143.1845703	0.32
148.9776306	0.31
151.0312195	0.54
153.3193665	1.50
155.0127869	3.39
156.9363708	0.26
161.2182312	0.17
163.059021	0.13
165.1120605	0.45
166.9818115	0.15
169.2239685	0.46
170.7697601	0.64
173.2049255	0.73
175.2013702	0.81
179.243515	0.85
180.8256683	0.50
183.2663269	0.73
184.2072754	0.16
185.1909027	0.36
187.2501678	1.74
189.15271	0.46
190.9663086	0.40
193.2162476	1.49
195.0847168	2.06
196.8983917	0.46
207.0053406	0.24
209.1873474	1.23
211.2595825	2.24
212.424469	0.17
213.2495422	0.43
214.9934998	0.23
217.2935486	1.68
219.1974182	0.18
220.1080933	0.28
223.131012	1.18
224.708252	0.63
225.3276062	1.49
227.3795166	0.82
229.2929382	0.46
231.1689758	0.50
234.2855225	0.18
235.1608276	2.06
236.1054077	0.68
237.0745239	0.92
239.209259	0.28
241.1238403	0.95
241.7581482	0.20
243.2225952	0.16
247.3995361	0.66
249.2080383	0.16
250.9378662	2.94
251.9503174	1.79
253.1732178	2.86
255.3537292	0.74
256.243042	0.59
263.1998596	0.49
265.1026001	2.40
267.2478638	1.29
268.1489868	0.29
269.2384949	1.34
270.1239624	2.03
275.1837769	10.23
277.3392334	0.27
279.0928955	2.77
280.2072449	0.67
281.1040649	1.45
283.4967041	2.47
284.3683167	0.55
287.8619385	0.34
293.2171936	100.00
294.3136902	0.57
296.3512268	0.76
302.4844666	1.00
310.5098267	2.10
312.2018433	0.54
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	264.86
Annotation	Unknow
Peak:m/z	Relative Intensity
180.8915558	0.31
190.8710785	0.19
196.8676758	100.00
219.1644745	0.35
246.3848267	0.13
247.4293823	0.26
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
107.1935272	0.64
123.1537933	1.21
135.0285187	3.07
144.831543	2.78
158.8100281	1.19
161.7906494	5.20
163.2092133	1.30
165.3256531	1.21
167.178833	3.30
178.131073	0.58
181.0952606	5.95
185.2753143	0.71
193.0323792	1.87
195.1193085	1.21
197.340332	2.65
199.1168671	2.05
201.0151978	1.45
204.032074	1.52
205.3560181	1.65
209.0810242	1.53
215.2208862	1.80
224.6882629	3.64
225.3218384	1.72
227.0757446	1.57
230.1298523	1.08
237.0670471	1.02
247.2380981	2.78
248.9651489	0.57
251.3570557	2.30
253.1595154	2.18
254.7064209	0.96
267.3961182	0.94
269.3120728	1.33
270.3101196	0.59
275.2006226	22.14
283.2656555	2.75
293.2105408	100.00
302.2788696	0.87
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	472.1583
Annotation	Folinic acid
Peak:m/z	Relative Intensity
136.0287628	0.04
148.0972748	0.15
152.1440125	0.10
167.1091614	0.03
172.0103607	0.04
176.1625519	0.15
178.7883301	0.02
191.1060181	0.28
193.1438599	0.27
204.2682495	0.05
233.2001343	0.11
236.3280334	0.07
247.1218872	0.03
250.2852173	0.19
258.2476501	0.15
265.4269714	0.09
273.4400330	0.11
275.4271851	0.22
277.2570190	0.17
280.2716064	0.07
288.2481384	0.02
300.2055054	43.34
323.3365173	0.18
339.3181152	0.10
343.1111450	23.32
343.7676392	0.07
351.0504761	0.17
357.7723389	0.10
360.3107300	0.91
365.6189880	0.17
367.2355957	0.16
384.2654724	0.22
385.2779846	8.69
386.3349304	1.87
404.2733154	100.00
405.5417175	0.19
411.3086853	10.10
425.1972961	0.07
426.0365906	0.09
428.2762146	2.73
429.3810120	16.23
430.5032043	0.22
436.3058167	0.02
437.5250549	0.22
454.3391418	19.65
465.4792786	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	383.1196
Annotation	Lactulose
Peak:m/z	Relative Intensity
111.2099915	0.06
126.8652878	0.07
173.1245422	0.21
191.0379028	100.00
218.3314209	0.04
322.1274719	0.05
345.6036377	0.04
365.1208801	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	730.88
Annotation	Unknow
Peak:m/z	Relative Intensity
228.9344788	0.14
230.3572083	0.04
257.2325439	0.09
273.0577087	14.11
274.1008911	5.68
275.0484924	2.18
300.1687622	0.05
304.9772949	0.12
387.0370483	13.19
388.0516357	12.26
389.0192871	5.81
486.1272583	0.13
487.3150635	0.04
500.9672241	45.32
501.9806519	61.20
502.9762573	46.23
503.9519653	0.09
516.9197998	0.08
565.9338989	0.27
570.1763306	0.42
575.0536499	0.14
584.0234985	0.06
601.1659546	0.20
610.1866455	0.10
611.1325073	0.34
614.9141846	37.81
615.9138184	91.30
616.8779907	100.00
617.9924316	0.41
625.9630737	0.12
627.8482666	0.37
629.0996094	0.32
641.0442505	0.04
643.9810181	0.04
644.9904785	0.08
646.1232910	0.14
655.1613159	0.39
656.0713501	3.23
657.0398560	2.20
668.7964478	0.12
673.4378052	0.69
674.2120361	1.02
675.1210938	0.58
683.3518677	0.24
684.0613403	1.27
684.9954834	0.58
686.0267944	0.32
687.0882568	0.23
697.8384399	0.56
698.8182373	0.36
702.0772095	0.11
703.2515259	0.26
712.1915894	0.22
719.6681519	0.08
842.8480835	1.18
843.8977661	1.17
844.8313599	1.99
845.8930054	0.90
956.9154663	2.44
957.9613647	3.44
958.7811890	3.49
959.8402710	2.68
1033.7028810	0.24
1056.8682860	0.04
1070.8703610	1.61
1071.9241940	1.93
1072.7420650	5.13
1073.6676030	2.90
1074.2741700	0.06
1184.9552000	1.07
1185.9375000	4.53
1186.7634280	8.51
1187.7989500	4.46
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	409.6684
Annotation	Unknow
Peak:m/z	Relative Intensity
130.0405579	1.82
145.0272827	4.75
154.1420593	0.42
170.8993835	5.48
171.5257874	1.49
178.1082153	1.46
217.0569305	67.64
218.2461548	3.58
235.2993469	2.17
241.3163757	0.46
244.4538879	1.50
249.2707825	0.57
251.1138611	0.42
260.2793579	0.53
263.1802979	0.57
266.9791565	0.80
273.7422485	1.10
275.3607788	0.56
277.4018555	6.46
285.1677246	1.28
291.1814575	1.61
293.7572021	2.86
308.4359741	0.71
318.2272949	0.41
327.3060608	15.30
328.0152283	6.62
331.8660278	0.67
334.4212646	0.99
336.2880249	72.63
337.3607178	3.26
338.5605774	2.85
345.1701660	9.19
346.0190735	6.89
350.9871826	1.27
351.8480225	0.68
361.3117065	2.41
372.1589050	2.91
374.7427063	3.69
375.4242249	0.72
378.1973572	0.23
392.0039368	4.96
392.6290588	1.85
394.2284241	0.86
400.8137512	100.00
403.4193420	2.06
420.2616882	5.54
437.2029419	24.23
438.3130188	6.24
439.3641968	1.20
441.2133789	1.63
455.3460083	14.08
456.4408569	4.08
491.2614136	1.62
492.2908630	0.86
492.9394226	1.81
504.2052612	0.82
509.3749695	0.64
510.6688538	1.21
527.2056274	1.02
532.4723511	4.35
542.0069580	0.68
550.3814087	5.72
565.6980591	2.18
566.3948364	38.19
567.4849854	11.32
584.3157959	42.59
585.2942505	8.06
586.3357544	2.02
653.1806030	1.13
690.0644531	0.53
748.9453735	0.86
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	696.3829
Annotation	Unknow
Peak:m/z	Relative Intensity
199.9174194	0.39
201.2243805	0.35
222.0306396	1.49
223.2255707	0.63
227.9398499	1.92
229.0903625	0.70
240.3058472	4.48
241.0845490	0.84
242.4127808	0.28
258.1250916	2.27
259.1412048	0.55
267.9228210	0.20
281.6070251	0.26
299.7634277	0.33
300.5393066	0.57
301.2265015	0.47
313.0739746	5.67
314.2325439	1.85
315.2254028	0.26
317.2484741	2.16
318.4504395	1.33
323.3557739	0.17
324.2791748	0.26
326.2708130	0.53
336.5341187	0.21
341.1937256	8.13
342.0570984	2.90
346.8825684	0.45
350.6338196	0.23
351.2720337	0.47
354.4684448	0.32
368.2122192	1.37
369.4583130	1.95
371.4110107	3.97
372.4139404	1.16
386.2739258	1.06
387.7757568	0.34
401.8051758	0.41
427.1522827	0.17
428.4318848	2.78
429.2808228	0.23
432.5772095	0.16
435.4039917	0.24
438.2328491	0.41
446.5183716	3.24
447.3593140	0.77
448.4200439	0.13
454.2179565	4.51
455.1533203	1.74
463.4093018	0.53
465.6725464	0.61
470.3612671	2.57
473.5049438	0.98
478.4793701	0.20
480.4297485	0.58
481.5924683	0.26
482.6304932	0.69
486.1806030	0.32
489.5606079	0.75
490.2355347	0.60
493.3728638	0.53
494.6496582	0.30
495.6542358	0.37
496.6771851	0.19
499.3069458	1.58
500.4802246	0.73
508.3977661	0.68
527.4564209	3.22
530.0739136	1.33
530.7387085	0.76
537.4458618	0.28
539.0018311	3.46
539.8057251	1.17
540.6166382	0.41
541.6672974	0.30
546.2925415	1.89
557.1257935	3.63
557.8072510	1.72
558.6681519	1.23
563.3247070	0.13
564.4652710	0.55
572.2048950	2.74
574.2594604	2.81
575.3706665	2.57
576.5944214	0.89
583.5218506	0.25
585.8724976	1.42
586.4779663	0.40
591.5154419	5.25
592.5236816	4.84
593.7905884	0.58
594.4540405	1.80
595.1836548	1.58
602.7370605	5.28
603.3958130	0.22
604.1046143	1.31
606.8938599	0.62
607.7404785	0.39
609.5543823	0.48
614.1982422	0.45
614.8661499	0.32
622.3504028	0.30
625.5219116	0.21
628.5333252	0.39
636.4666138	0.60
640.6705322	7.43
641.3147583	1.96
643.6539307	0.69
645.4810791	18.90
646.2982788	5.77
647.0972290	0.17
650.6994019	79.42
651.6153564	7.05
659.4915161	100.00
660.1814575	39.61
661.2866821	2.80
662.7176514	2.64
664.3073120	0.52
666.4465942	0.35
668.5521240	1.00
670.4832153	0.14
678.7403564	0.30
679.5449829	1.50
680.4464722	2.70
688.4254761	30.45
689.5419312	2.04
690.2415161	0.93
694.3674927	0.16
705.4357300	0.78
706.4637451	1.17
707.4650879	0.34
709.4113159	0.32
710.8387451	0.41
716.2355347	1.09
718.3690796	0.67
720.6110229	0.31
722.4507446	0.24
726.6051636	0.61
727.5319214	1.36
729.9856567	0.17
733.4986572	0.57
735.7871094	1.22
751.6875610	0.23
784.5289917	1.91
785.8015747	0.43
790.7177124	0.40
801.5790405	3.36
802.6886597	9.52
803.6068115	1.94
804.3374634	0.56
818.5442505	9.90
819.5233765	20.59
820.5081787	3.88
821.6168823	0.87
829.4627075	0.44
834.3882446	0.34
834.9982300	1.49
835.7995605	0.29
836.6351318	0.35
840.5158081	0.16
846.5590210	1.39
847.6101685	0.80
863.6314087	1.75
864.5322876	1.24
907.5769653	0.27
919.0143433	1.11
919.6706543	0.31
921.6535034	0.47
922.7247925	0.42
929.7888794	0.62
930.6772461	1.47
938.6422729	12.84
939.6882324	21.81
940.6364746	4.84
941.8366699	1.92
942.8717651	0.16
946.5889282	18.90
947.6574707	26.84
948.7841187	9.97
949.7559204	2.27
953.6245117	1.15
959.3867798	1.83
960.7286987	2.11
963.8037720	0.40
964.8882446	0.16
976.7284546	0.31
977.7183228	3.79
978.9780273	0.81
986.8488770	0.83
1013.9597780	0.34
1031.9514160	0.92
1032.8493650	0.28
1035.2727050	0.76
1042.6398930	0.82
1048.9475100	0.13
1052.1336670	3.88
1052.9848630	6.88
1053.8707280	1.62
1054.8349610	1.13
1058.5578610	1.28
1059.5957030	2.79
1060.6263430	1.14
1062.0725100	0.36
1075.7539060	9.43
1076.7457280	40.09
1077.8159180	9.86
1078.8415530	0.89
1092.0253910	0.86
1092.8725590	0.35
1093.8183590	4.79
1094.9108890	0.56
1171.7241210	0.33
1183.8249510	0.61
1185.9018550	0.20
1186.7912600	0.14
1187.5062260	1.26
1188.1306150	1.24
1189.9086910	0.65
1203.5073240	1.72
1204.7381590	12.41
1205.7767330	3.03
1206.7213130	2.88
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	311.1688
Annotation	5S-HETE-d8
Peak:m/z	Relative Intensity
96.99326324	0.42
98.75457001	0.56
119.0077667	1.44
150.9284363	0.48
161.2835693	0.81
170.0502625	3.45
172.947937	0.48
183.011673	100.00
184.0903778	14.75
185.0414734	1.34
197.0695953	14.76
198.0688171	6.96
198.9021759	1.43
211.1469116	1.51
212.1963196	0.93
213.2095032	0.23
223.4907227	0.32
225.9805298	1.82
233.0233765	0.89
237.1429138	0.37
239.3091736	5.58
240.1911926	0.96
247.1193848	9.98
247.7933655	1.24
249.4458008	2.33
251.3925171	1.13
253.2640076	1.31
255.3972473	0.20
257.2625732	0.27
261.4021301	1.12
267.1448975	7.34
268.4183655	0.98
275.23172	1.49
279.1123047	0.56
283.5386658	3.05
293.2612915	14.58
294.4876099	0.91
296.130249	0.66
311.3519287	13.87
312.1989746	0.37
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	284.0942
Annotation	Unknow
Peak:m/z	Relative Intensity
85.9530945	0.91
92.8404999	0.42
94.9606400	0.45
109.2531586	1.14
120.8024902	0.47
123.2049103	1.40
124.8551331	0.84
125.8009644	0.31
130.0855408	1.01
131.0597229	3.61
134.3521423	0.48
135.0741882	0.97
139.2500305	0.37
148.8638916	1.22
151.2452240	0.42
163.0328217	100.00
177.1376648	0.31
183.7290039	1.25
212.1650391	1.21
213.6658325	0.48
215.1383057	0.78
222.2487183	0.72
223.2076416	0.80
227.3277283	0.29
236.1474304	0.94
239.2132568	3.32
243.1434631	1.42
246.0515747	0.55
247.2169495	2.10
253.3222961	0.40
254.0758667	2.25
256.1838989	1.27
266.0737915	13.41
266.9818420	2.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	315.072
Annotation	4-(beta-D-glucosyloxy)-3-hydroxy-benzoic acid
Peak:m/z	Relative Intensity
93.11414337	0.31
100.8484802	0.80
107.9866638	4.68
109.0194244	7.46
119.1234741	0.57
120.8206024	0.31
122.0787964	0.47
123.1499023	0.76
135.1199341	1.42
151.1416016	5.10
151.9491882	31.74
153.012146	100.00
161.2054443	0.23
163.0872345	4.60
165.0141754	20.19
167.0789795	0.93
177.0840454	0.59
178.9981384	2.22
181.134552	3.71
189.0247345	0.75
193.0391235	0.26
193.6577148	0.27
195.2637634	1.48
201.0539551	0.55
206.9743652	1.78
217.0893555	0.30
219.0887756	0.29
222.1961975	0.94
222.8900146	1.52
225.0747681	6.65
229.2312927	0.94
230.9856873	0.39
235.1990051	0.56
237.1503296	1.01
243.0120544	1.24
247.2203369	0.38
252.4524231	0.92
253.3697815	0.45
259.1552734	0.20
269.0157471	3.61
270.0176086	0.87
271.263092	1.75
273.2689514	0.22
277.5424194	0.44
278.3482056	0.84
279.2613831	1.67
280.2592773	0.74
281.3799744	0.44
285.2529907	0.84
295.1751099	1.10
296.0658264	1.58
297.211792	1.76
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	493.2287
Annotation	L-Linalool 3-[xylosyl-(1->6)-glucoside]
Peak:m/z	Relative Intensity
148.9894104	0.09
164.7825317	0.04
205.0590210	0.09
227.2954407	0.04
285.8869629	0.09
297.1347351	0.09
311.3883362	0.05
312.3397827	0.16
326.3603210	0.08
327.3412781	0.07
335.1465454	0.25
360.2664490	0.05
363.4235840	0.08
397.8043518	0.04
410.3234558	0.07
413.9686279	0.06
415.6101379	0.08
421.2942200	0.15
424.4660034	0.12
431.1427612	0.07
433.5762634	0.23
440.8770752	0.05
442.1989441	0.15
447.2986755	100.00
448.4009705	36.15
449.8469849	0.36
450.9014587	0.32
455.1839905	0.12
456.5463257	0.27
457.3917236	0.24
458.2337341	0.50
475.7219849	0.55
477.4175720	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	205.0966
Annotation	Ethotoin
Peak:m/z	Relative Intensity
82.9965668	0.01
108.0720520	0.05
108.9448700	0.08
113.8065643	0.01
115.1897278	0.09
118.0964355	0.02
123.0490570	0.02
126.9375153	0.11
132.1369629	0.10
139.0262451	0.11
145.0828705	0.16
145.8750000	0.02
150.8855438	0.05
159.1177826	0.09
163.1962738	0.08
164.0161591	0.01
169.0868988	0.29
177.0191803	0.06
188.0118713	100.00
195.0052032	0.05
196.0865326	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1091
Annotation	5-O-(alpha-Mannosyl)-myo-inositol
Peak:m/z	Relative Intensity
97.07098389	0.51
100.9820557	9.08
106.8566742	0.61
113.0102692	20.97
115.0536575	1.24
118.932373	16.60
125.0272369	2.38
130.925415	8.13
133.0128479	0.25
143.0558167	22.33
148.985672	3.46
155.342865	0.13
161.026062	20.17
177.5677795	0.21
179.0567322	100.00
190.9111938	0.13
221.2022095	0.57
243.1341248	0.17
255.2767029	0.13
257.0532837	0.07
260.9348755	0.22
269.190918	0.30
270.3453064	0.08
279.8163452	0.12
280.9980469	2.29
295.2960815	0.09
305.1107178	0.18
323.1015015	0.10
327.7805786	0.06
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
94.97599792	1.15
96.82162476	0.83
109.094017	1.00
111.0128479	1.97
123.7852478	0.46
125.0779877	1.76
126.9455032	1.14
128.855484	0.56
130.9409027	1.60
133.0597839	0.91
134.9346924	1.92
137.1144867	0.43
138.4182892	1.28
139.1136169	1.68
143.0075073	1.63
152.8721008	1.54
154.9954834	1.17
156.2852173	0.22
157.1131287	0.53
163.0555725	0.72
164.9889526	0.39
166.9837799	0.99
179.1344299	0.73
181.2805786	1.35
181.9774323	0.75
183.0589294	2.33
187.0170898	0.31
193.2499695	1.17
195.085556	1.98
196.9430084	1.67
199.008728	1.23
205.3432922	0.79
207.1274719	0.36
209.1672668	0.45
211.144104	1.30
213.1672668	1.70
220.7618103	1.04
225.3277283	1.18
227.2449646	3.71
229.0974121	1.66
232.9915771	1.51
233.8736877	1.29
235.1178894	0.62
237.0370789	1.48
241.2660522	0.56
247.0503845	0.99
251.2129211	4.08
253.2148743	7.01
255.0714722	0.35
265.505249	1.92
269.434021	0.60
275.3060608	12.38
283.2423706	2.54
288.4398193	0.82
291.7810669	0.22
293.208313	100.00
298.7688904	0.65
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.242
Annotation	Moniliforminol A
Peak:m/z	Relative Intensity
92.8122406	1.09
94.97620392	0.50
96.95111084	0.94
104.9393616	0.32
109.149765	3.24
110.7218475	0.58
123.0078583	4.30
135.1376038	2.72
137.1139832	1.36
139.0188599	0.36
148.6479187	2.22
151.0591278	0.40
161.075592	2.28
165.1339264	1.15
167.1694489	1.67
169.1108398	1.43
171.0798798	2.24
183.183609	2.20
185.0886383	1.27
187.2577057	1.18
193.1509705	1.84
195.2755127	0.44
196.985199	5.83
203.3776245	0.91
208.9114075	1.67
211.2796326	2.45
218.9443359	1.36
221.0202637	8.82
223.0820312	1.12
233.1876221	1.57
237.2886353	3.18
239.1679688	25.65
243.3823242	1.68
251.3364868	7.29
253.1277771	2.97
255.2397766	0.57
257.415802	1.01
261.488739	0.68
279.2362671	100.00
280.4334106	0.80
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	309.2321
Annotation	Pentazocine
Peak:m/z	Relative Intensity
91.0436249	1.66
93.0055618	0.80
93.9767914	1.30
104.8779449	0.17
105.9286728	0.77
108.0184402	1.32
109.0081558	0.47
117.2572403	6.58
118.0260391	21.42
118.9633942	0.62
120.1425247	0.53
121.0933304	0.20
126.9961472	1.26
128.2601929	0.17
129.0945435	0.66
130.0389557	1.61
130.8728180	1.35
132.2108459	0.62
133.0598297	1.03
141.9420319	2.11
143.0742035	2.86
143.9076538	2.66
145.1015930	1.36
146.1667175	1.20
147.0731812	0.62
153.9947205	1.38
156.1703491	1.04
157.1454163	1.10
158.1113586	2.55
158.9375763	2.42
160.0286560	1.33
161.1352997	0.23
164.1608582	0.34
167.5529175	1.07
168.2736053	0.63
169.3456116	0.28
170.1096497	3.66
171.1116638	4.61
174.8558655	0.67
178.6409302	1.20
180.1393890	0.73
181.1700287	0.24
182.0333099	2.21
182.9494171	2.09
183.9252625	1.83
185.0345764	2.68
192.2119751	100.00
193.0762634	0.44
194.1464386	6.06
195.2303467	1.43
196.2119751	2.42
197.1974792	3.72
198.2818146	1.50
199.2812653	0.38
203.3092957	0.42
206.0607910	0.48
207.0658875	1.13
208.0538635	1.13
209.1750488	10.69
210.0907593	7.18
211.1622314	7.97
212.3731689	0.67
216.3506165	1.19
218.2776794	0.75
220.3281250	0.37
221.1501770	0.25
222.1374817	1.66
223.1643066	7.90
224.1414795	8.28
225.1168823	7.00
227.1985168	3.29
228.1471863	2.62
234.7154541	0.25
237.1030273	0.38
238.3132324	0.65
249.5143127	0.76
251.9728088	1.60
253.2406311	0.39
254.3988647	0.39
264.4395447	0.60
266.3001709	5.52
268.2021484	35.70
273.3610840	0.66
277.2530518	0.60
279.3829956	1.34
280.3162231	3.57
281.2368469	2.81
291.2985840	2.33
292.3252258	14.63
293.3919067	0.67
294.3480225	8.61
295.3561401	0.95
307.3026733	14.76
308.7086182	1.47
309.4489441	2.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	454.2927
Annotation	PE(16:0/0:0)
Peak:m/z	Relative Intensity
167.6715393	0.28
193.0768280	0.73
209.3491058	0.55
216.9532166	0.62
230.3553467	0.44
255.3913269	0.35
256.4396362	0.78
257.3181763	0.43
268.2402344	0.27
271.0944214	0.56
282.1905823	0.50
285.3205261	0.25
299.2899475	0.81
300.3031616	0.29
311.1364441	1.18
313.3140564	48.04
315.1246643	0.40
321.4564514	0.48
326.4217529	0.31
328.3838806	0.53
338.3851318	0.61
340.1575317	0.34
342.3909302	0.63
354.2855835	0.91
355.3916321	3.19
356.4185791	0.98
367.7313232	0.30
369.1577148	0.83
371.1905823	1.06
382.5102539	0.98
383.4829102	1.56
384.6544495	0.28
385.4857788	0.50
388.2922668	0.90
393.2112122	5.26
393.8932190	0.41
396.1252747	0.30
397.4477844	2.79
398.4653015	1.02
410.4118042	0.70
411.2332458	0.42
412.1878357	1.60
413.3628235	0.25
418.1357727	1.22
421.3590393	1.08
422.2991028	1.84
422.9620056	0.67
424.7615051	1.15
425.3883972	1.57
426.2436829	0.63
427.4604797	0.44
430.2538452	0.65
431.8825378	0.60
436.3056335	100.00
438.3907776	1.23
440.3388367	2.94
452.5558167	0.88
453.3160095	2.58
454.0061340	1.75
455.2416382	5.64
456.0520325	1.71
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
206.9485779	4.44
278.7364502	3.32
290.8347473	100.00
323.1125488	8.42
360.1924438	0.71
374.6522217	18.26
398.7173462	0.34
412.8676758	1.84
440.8135376	0.88
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	590.683
Annotation	Unknow
Peak:m/z	Relative Intensity
176.3936005	0.15
207.0298004	0.18
215.0500183	0.33
232.0655365	1.04
280.9967346	0.09
294.7122803	0.12
302.9691162	0.13
355.2676392	0.54
364.5512085	0.09
370.9814453	0.70
413.2672119	0.10
416.5076294	0.31
422.8576660	0.26
427.1242676	0.77
438.9050293	1.07
452.7413330	0.50
454.6810913	0.93
492.0416260	0.30
493.2203979	0.10
497.1921997	0.22
505.7496948	1.07
506.7679443	100.00
510.5903931	0.52
521.1765137	0.30
522.8200684	96.84
543.9393921	0.81
544.8865356	4.33
548.8216553	1.41
556.8072510	0.14
559.8692017	0.49
567.2009277	2.40
568.2943115	0.20
572.8803711	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	521.1724
Annotation	Unknow
Peak:m/z	Relative Intensity
160.9161377	1.27
179.0748901	100.00
195.0644073	0.13
205.9801025	0.05
209.1743622	0.66
291.9317627	0.06
310.2189941	0.57
311.0438232	0.89
329.2376709	0.27
341.4085693	1.22
359.5326538	0.15
385.0826416	1.07
390.4503174	0.03
397.0722046	0.17
457.2362671	0.16
458.3905640	0.44
484.3905640	0.19
485.2505493	0.70
491.3529663	0.06
501.5231934	0.20
502.4898071	0.07
503.3766479	0.21
504.1625977	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	522.1829
Annotation	Herbicidin E
Peak:m/z	Relative Intensity
161.1024475	0.53
179.0738373	1.83
180.1734009	0.44
227.2079620	0.11
240.0926666	0.04
265.2930298	0.04
330.2720947	0.13
341.1755981	100.00
349.3583984	0.04
360.2450562	0.08
418.2719727	0.06
427.3243408	0.04
432.7926636	0.16
504.2564087	0.34
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
199.1184998	0.04
203.0175171	0.03
217.2283325	0.07
272.9617310	1.72
274.2723083	0.05
275.1610718	0.16
327.2472534	0.04
341.4893799	0.03
342.1082153	0.06
357.1031494	0.10
358.9898682	0.22
387.0328979	0.53
389.3380127	0.12
403.4888306	0.11
404.1174316	0.16
405.0465698	0.07
425.9310913	0.11
427.0331421	5.13
429.2352905	0.04
454.2651367	0.14
470.0490112	0.34
471.3073120	0.40
472.3989258	1.29
473.1191406	3.37
485.1476440	0.36
496.0662231	0.13
499.0595093	0.12
501.0443726	0.54
502.0994263	0.08
503.2307739	0.03
506.2212524	0.20
512.8284302	0.59
518.4264526	0.10
525.1913452	0.10
528.3886108	0.15
531.0198364	0.04
540.9000244	100.00
542.0181885	0.40
542.8845825	0.59
545.1848755	0.15
554.3181152	0.18
555.1788940	0.13
558.0898438	0.17
559.1176147	0.48
569.1076660	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	148.06
Annotation	3-Aminopentanedioate
Peak:m/z	Relative Intensity
83.8708115	0.93
84.8825684	0.07
101.9367218	18.54
130.0052795	100.00
131.0340271	8.52
146.8362122	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	532.8752
Annotation	Unknow
Peak:m/z	Relative Intensity
159.0141754	0.14
175.0293884	0.81
228.9978943	0.08
245.1769714	0.17
273.0359497	1.71
274.1267090	0.03
276.1580811	0.01
285.1683350	0.01
289.0554199	13.71
303.1342468	0.07
305.0362549	4.24
366.3047485	0.02
387.0814209	1.75
388.0194092	0.29
389.1931152	0.18
403.0364380	8.36
403.6696777	0.01
416.9848022	0.18
418.9473267	100.00
420.0720825	0.02
442.1750488	0.02
443.0628052	0.07
443.9438477	0.06
445.5343628	0.04
448.0527344	0.11
458.2849731	0.05
459.0040894	0.12
461.0933228	0.12
475.2231445	0.01
477.0101929	0.02
478.4522095	0.02
485.2017822	0.06
485.9315796	0.22
486.9392090	1.37
498.1157837	0.02
504.8720093	0.10
505.9562378	0.05
523.1554565	0.03
533.0310059	0.01
541.3340454	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	401.1452
Annotation	Benzyl beta-primeveroside
Peak:m/z	Relative Intensity
113.0696793	0.33
118.9044952	0.10
125.0320816	1.99
130.8962555	0.71
142.9627380	0.64
148.9452209	0.93
158.9743805	2.26
161.0975494	19.22
163.0060883	0.10
191.0367432	1.81
192.0928040	0.09
192.8782196	0.82
207.0720520	0.17
215.0901184	0.80
221.0916138	0.09
233.0363159	7.52
244.8583984	0.12
269.1512756	100.00
293.2555542	5.97
296.2069702	0.21
297.1041260	0.12
309.0454102	0.13
311.2998962	0.69
314.2261047	0.13
317.0324707	0.11
325.3811035	0.16
353.1830750	0.32
355.2280884	0.56
357.1766357	0.85
364.6021423	0.28
365.4054871	0.64
371.2756042	0.08
380.9957581	0.14
383.3172302	0.97
384.2296753	0.47
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	280.25
Annotation	alpha-Butyl-omega-hydroxypoly(oxyethylene) poly(oxypropylene)
Peak:m/z	Relative Intensity
108.8440628	0.24
114.9806366	0.71
127.2029572	0.23
149.5038452	0.46
150.1449127	0.44
173.2628326	0.24
187.0313110	0.46
191.2940216	0.54
192.6253357	0.32
194.1605835	0.18
205.7699890	0.50
224.1864319	0.59
232.0868835	0.53
233.8526917	0.23
235.0449829	0.64
235.8786621	0.32
238.3537598	0.94
239.2543945	0.84
243.8845215	1.25
249.0248413	100.00
249.6712952	0.30
250.3138428	0.82
261.1712646	0.43
262.0772095	4.06
271.5093689	0.62
280.1668091	0.59
283.7600403	0.57
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	285.22
Annotation	Vitexifolin C
Peak:m/z	Relative Intensity
82.97606659	1.03
94.99656677	0.45
104.7827911	0.64
109.072319	2.20
111.1594391	0.55
116.0784302	0.72
123.0057373	0.65
124.8605499	2.02
128.8312836	2.46
133.0664368	2.29
137.267395	0.69
143.1120605	4.14
147.1316986	1.58
149.9088745	0.55
151.1616821	3.07
155.1170044	4.31
159.1096802	2.08
169.0116577	1.66
171.1657715	4.57
182.1214905	0.44
183.1338348	7.01
185.0154419	3.66
187.2764435	1.18
197.0408936	4.07
200.3005676	3.86
203.0822449	1.01
204.1916199	0.64
206.9453735	7.67
208.9428406	0.74
211.3053894	1.78
213.5175781	0.95
215.1067505	1.20
221.1228638	2.05
225.2569275	1.86
227.0252075	0.81
228.4326172	2.82
241.2399902	1.56
243.0377808	1.52
244.052948	0.61
249.3302917	3.14
253.1421204	2.47
257.3098755	0.59
258.1365051	1.00
266.2293091	2.95
267.2072754	100.00
268.0865784	1.03
285.3825684	1.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	551.1769
Annotation	Prinsepiol 4-O-beta-D-glucopyranoside
Peak:m/z	Relative Intensity
161.1733093	0.02
162.6751709	0.06
165.0295715	0.52
166.0440979	0.07
178.0936584	0.39
179.3580627	0.04
181.1631775	0.07
193.0862885	10.56
194.0810852	1.19
195.1169586	1.75
196.1322632	0.43
218.288559	0.03
234.0707245	0.02
235.27565	0.16
236.1339722	0.02
246.9683228	0.06
285.1028748	0.24
291.3952026	0.02
297.0090332	0.11
313.0140991	0.01
315.7633667	0.02
341.213562	12.79
342.2893677	3.06
343.291748	0.14
345.0967407	0.09
346.4230957	0.03
347.7340088	0.03
355.3311157	0.15
356.3446045	0.05
359.0357056	0.04
362.2197266	0.04
368.4155884	0.12
371.0698242	0.79
372.3103027	0.03
375.4854736	0.08
383.2433472	0.04
389.1189575	100.00
390.2258301	14.40
403.2546997	0.20
421.2896729	0.09
431.1760864	0.75
432.380249	0.04
436.2247925	0.04
449.5509033	0.09
456.2938843	0.06
460.9805908	0.26
462.3150635	0.10
463.4341431	0.50
464.5755005	0.04
488.0673218	0.09
490.7670288	0.24
491.4803467	0.29
492.3810425	0.03
505.3253784	0.78
506.5707397	0.23
514.3126831	0.07
516.3882446	0.15
517.512207	0.05
518.3999023	0.03
522.2388916	0.02
531.331543	0.03
533.4983521	0.50
534.5682983	0.08
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
154.5660095	0.12
158.9824371	4.75
159.9055176	1.09
161.1005249	0.61
175.2551270	0.10
199.1441956	0.64
200.7275085	0.09
229.2219849	1.12
230.0711060	0.34
230.8541107	0.12
271.3785706	0.11
272.9845276	55.17
274.0412903	33.89
275.0265808	28.73
387.0190735	61.11
388.0326843	91.64
388.9697571	100.00
389.5854797	0.17
428.0210571	0.05
429.0849304	0.29
430.8707581	0.39
456.2745361	0.07
460.1020203	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	520.3388
Annotation	PC(18:2(2E,4E)/0:0)
Peak:m/z	Relative Intensity
184.0058289	21.27
240.0295105	0.38
244.6062927	0.09
305.9401855	0.15
319.3269043	0.24
365.5594482	0.21
387.5308838	0.13
443.2720947	0.29
484.2046509	0.24
502.5619507	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	311.169
Annotation	5S-HETE-d8
Peak:m/z	Relative Intensity
93.10533142	0.14
120.1885605	0.09
124.8484802	0.20
141.0866699	0.40
152.983429	0.34
167.1130829	0.40
170.0288696	4.32
178.8053436	0.70
183.0128174	100.00
183.9677734	12.38
185.1745605	1.42
197.1200256	5.47
198.0648804	3.26
200.2845001	0.29
207.4620972	0.17
211.203186	0.95
212.1606445	0.33
223.1624756	0.32
225.0213013	2.66
226.1951599	3.24
229.1244507	0.25
239.2829895	5.27
240.4502563	2.97
241.399231	0.38
243.2835388	0.14
247.2059021	4.93
249.1629639	1.31
251.2254333	1.43
253.066925	1.42
254.1590881	1.48
263.0784912	0.19
265.2297668	0.40
267.2648621	6.99
275.1999207	0.50
277.2557373	0.62
281.2645569	0.51
282.9853516	0.32
284.3229065	0.20
291.2545166	1.24
293.2557373	7.00
295.2401123	0.84
311.2433472	14.06
312.6315308	1.99
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	354.85
Annotation	Unknow
Peak:m/z	Relative Intensity
187.1016846	0.10
198.8344269	0.02
211.1922607	0.03
216.9801331	2.16
219.0075073	0.60
233.2439575	0.04
248.1736755	0.02
263.4181213	0.02
270.9491577	100.00
275.0249634	0.10
279.0775757	0.03
285.1458435	0.05
286.9584351	3.21
308.9122925	5.18
310.9167175	0.06
337.1129761	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	599.3884
Annotation	Unknow
Peak:m/z	Relative Intensity
178.0091553	1.91
180.9600372	0.96
190.1658325	1.03
207.3269043	0.70
215.3722992	1.18
219.0833740	0.57
233.1630707	2.64
234.1210022	0.45
234.8842163	0.83
239.0576477	1.38
245.0308838	1.78
248.7644196	1.10
249.5305176	1.95
250.2113800	2.16
253.5652161	2.82
255.0923767	1.14
257.1894836	3.44
265.1310425	2.88
267.1105957	1.24
269.2811279	1.76
270.8982849	2.77
272.3058777	3.12
277.1904907	1.89
278.5520325	2.50
279.3188782	4.63
281.4125061	7.76
283.3128052	2.81
287.0786743	1.13
289.0895996	1.72
290.2690735	2.13
291.3724365	2.27
293.0479126	7.91
294.2369385	1.10
295.2843628	2.60
297.3474731	0.56
298.0051270	1.60
299.4057007	0.78
300.8337402	1.81
303.3662109	3.53
304.2329102	2.79
305.2062988	0.96
306.1951904	1.21
307.2709961	4.87
308.1334229	0.50
309.1652222	5.76
310.2950439	1.94
311.3983765	1.54
315.2091370	9.18
316.4821167	0.56
317.2205811	19.59
318.0220642	0.31
319.4592896	1.67
321.0172119	0.66
323.4160767	4.49
326.4127808	5.32
329.2049561	10.36
330.2062378	4.58
331.3920898	6.73
332.2785034	4.32
333.2218628	9.17
335.2608032	1.42
340.0764160	3.17
341.3473511	1.77
342.4709473	5.81
343.2834473	6.50
344.2119141	4.25
345.2430420	13.60
346.1630249	2.13
347.4312134	12.08
348.1936646	2.77
351.3413696	8.05
354.3983765	0.66
355.5493774	7.35
356.3092041	3.22
357.0933228	8.20
357.8080444	2.08
359.3223267	8.64
360.2924805	1.01
361.1610107	2.88
362.0218506	0.83
363.9541016	5.67
365.0822144	0.55
366.0238037	1.47
367.3580933	3.26
368.2733765	4.61
369.3202515	1.52
371.3098755	10.98
372.2809448	5.68
373.3217773	3.36
374.4725342	3.37
375.4575806	3.00
379.4604492	2.05
380.2539062	1.89
382.4583130	1.34
383.2777710	9.46
384.3361816	3.10
385.3438721	3.03
387.5011597	5.47
388.2012329	6.71
389.2429199	13.88
391.3538208	1.08
393.2058716	3.29
394.3662109	2.25
397.1564331	4.48
398.3081665	0.47
400.4746094	3.30
401.3084717	3.06
403.4276123	8.55
404.4041748	1.38
405.3009644	3.14
406.3981323	2.84
407.4083252	1.05
409.2097778	1.13
411.3928223	7.30
413.0987549	3.22
415.3761597	9.92
416.3796997	3.64
417.4827271	7.06
418.4396362	1.36
419.4322510	7.88
421.0746460	4.23
422.2554321	0.45
423.4556885	1.93
424.5040894	4.80
425.2918701	2.76
427.5471802	8.96
428.5976562	0.61
429.5009766	7.19
430.6513672	3.80
431.4653320	2.58
432.4696045	1.12
433.4757080	5.72
434.4406128	0.99
435.5944214	5.69
437.4690552	3.20
439.4525146	5.04
441.0610962	6.89
443.3248291	10.49
444.4109497	4.04
445.2810669	13.89
446.4495239	5.28
447.6414795	2.32
449.8325195	2.84
451.4105835	3.10
454.9750366	4.20
455.6467896	4.27
457.3919067	8.42
458.4519043	5.84
459.5210571	16.12
460.6027832	2.34
461.3442383	2.84
465.2834473	2.11
466.4475098	3.00
467.4966431	0.99
468.4381104	2.17
469.4549561	16.97
470.2590942	0.78
471.3939819	34.97
472.4144287	8.43
473.4453735	25.98
475.4570312	5.75
476.5165405	0.67
479.4099731	2.47
481.7985840	1.89
482.7474976	4.91
483.6517334	2.89
484.6381226	3.70
485.6467285	7.52
486.5830688	4.41
487.4986572	11.68
489.4415283	7.27
493.5107422	3.80
495.5045776	4.01
497.3906860	6.13
498.0046387	1.78
499.6101685	15.65
500.5483398	20.25
501.5438232	28.74
502.1911011	0.84
503.4329834	1.07
507.5534058	1.46
511.6250000	5.65
513.4402466	1.57
514.4822998	7.87
515.5466919	3.56
516.5267944	3.67
517.6016235	10.85
524.4767456	0.76
527.6990356	4.78
528.6659546	5.17
529.6633911	1.11
530.4464111	0.39
538.2122803	5.67
540.0505981	8.00
541.6532593	2.09
542.6218872	16.08
543.5122681	34.67
544.7432251	6.75
545.6365356	4.53
547.4493408	1.07
551.4440308	0.61
552.6099243	0.80
553.5468750	15.45
554.2596436	1.68
555.5296631	3.64
556.5304565	2.00
557.5170288	13.67
558.5967407	4.64
563.6005249	13.46
568.5786133	0.61
569.7203369	7.00
570.6847534	2.10
571.5665894	56.52
572.6131592	2.95
579.7100830	1.54
581.6213989	100.00
584.5917969	1.05
601.6680908	0.56
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	616.68
Annotation	Unknow
Peak:m/z	Relative Intensity
297.0128479	0.07
309.2896729	0.19
335.5238647	0.11
364.9208374	0.36
380.7072754	0.24
402.9362793	3.32
410.9553223	0.10
418.8474121	0.97
444.9716797	0.19
446.9173584	0.46
448.7817993	11.79
464.8291016	0.99
479.0350952	0.16
480.9060059	0.07
484.8470459	0.31
486.6042480	13.00
488.4096069	0.09
489.4629517	0.14
509.8490601	0.06
527.0191040	0.09
528.8050537	0.07
529.7723999	0.30
531.1009521	1.28
532.6779175	45.89
548.8139648	0.68
557.5764160	0.25
560.9448242	0.60
570.5840454	100.00
571.2614136	0.47
572.7005615	0.05
574.4711304	0.25
581.9588013	0.09
588.5768433	0.17
592.5405884	0.06
593.8928833	0.53
598.8929443	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1088
Annotation	fagopyritol A1
Peak:m/z	Relative Intensity
100.928215	10.83
106.883049	1.23
112.9911194	24.19
118.9882507	14.42
124.8784714	0.74
130.397522	2.89
131.0777588	10.57
142.996521	8.97
147.9513855	1.32
149.0914154	4.69
159.0637207	1.39
160.9734802	24.07
179.055603	100.00
242.9966736	0.62
245.1633301	1.09
247.1183777	0.77
249.040802	2.77
257.2413025	0.35
265.3378601	0.90
280.9641724	4.51
293.6697388	0.83
295.1132812	14.28
297.0649414	5.50
298.3814087	2.60
305.1724854	2.67
307.3442383	1.53
323.1125488	12.72
335.3120117	3.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	490.1752
Annotation	Unknow
Peak:m/z	Relative Intensity
148.0418243	100.00
161.6427002	0.42
240.1313019	0.35
270.5382080	1.00
289.0416260	0.63
306.9952698	0.50
309.8955688	2.27
325.2046509	0.44
327.9160767	1.60
472.0022583	0.62
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	265.11
Annotation	Thiamine
Peak:m/z	Relative Intensity
80.9557037	0.42
84.8750687	0.17
98.4930115	0.67
109.9893646	0.39
112.7811127	2.00
121.9245453	100.00
123.1625519	0.29
126.0194702	1.74
144.0157928	53.07
156.0009460	6.30
175.1900940	0.15
176.9286957	0.21
190.1453094	0.08
190.9359741	0.94
196.9581146	2.64
203.0283966	0.05
209.0618134	0.90
214.4130402	0.14
224.2080383	0.19
229.5049591	0.25
234.3188019	0.08
235.1091309	0.29
247.1647186	0.41
248.1952515	0.43
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	533.1724
Annotation	Unknow
Peak:m/z	Relative Intensity
148.2356873	0.11
155.1326294	0.06
171.1225891	0.12
173.0825500	0.56
191.0298462	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1091
Annotation	Lactulose
Peak:m/z	Relative Intensity
101.0028229	5.97
112.9194260	16.53
118.9496384	15.68
125.0338593	1.61
131.0401611	8.33
142.9921112	23.58
149.0379028	5.15
160.9854889	24.62
178.9357910	100.00
220.7044067	0.39
254.8555908	0.54
281.0223694	2.27
298.1746521	0.16
305.4606018	0.44
308.9378662	0.45
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	604.1729
Annotation	Unknow
Peak:m/z	Relative Intensity
172.0909119	0.10
188.1095428	0.11
200.1528931	0.82
202.0086365	9.43
218.1777344	1.92
219.2986755	0.78
244.0082703	0.46
259.0536499	0.06
262.1001892	100.00
439.1630859	0.06
442.5163574	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	516.82
Annotation	Unknow
Peak:m/z	Relative Intensity
181.0449219	1.50
196.9561005	1.54
221.0224457	0.08
264.3437500	1.05
264.9617920	10.63
280.8626709	4.78
285.1861572	0.07
296.8812866	0.19
302.7568970	0.22
325.0657349	0.05
332.8527832	0.08
337.3239136	0.04
347.0764160	0.06
348.7642212	60.38
363.2886963	0.24
364.7917480	16.67
380.1445923	0.42
380.9778442	0.20
430.7611694	2.87
432.6184692	100.00
433.3425293	0.45
436.7438965	0.08
448.6824951	1.65
470.3302002	0.10
472.8923950	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	437.171
Annotation	Unknow
Peak:m/z	Relative Intensity
130.0663910	0.70
161.9784546	0.88
176.7989197	0.33
179.0972595	0.42
185.9448853	0.77
244.8663025	0.30
259.1931763	0.35
262.2342224	0.60
265.4275513	0.21
269.3128662	0.20
271.1849976	0.40
276.6002197	0.58
291.0694580	0.76
291.8585205	0.18
299.8511963	16.99
300.8178101	0.72
308.0662537	1.25
312.5522766	0.16
321.1844482	6.39
321.8524780	2.56
324.2817993	0.47
331.3974304	0.30
335.3524170	0.75
354.5780029	2.42
355.3860779	0.40
356.1979370	0.68
357.9694214	1.40
363.7838440	55.73
364.6820984	15.32
365.7355957	0.30
367.0351257	0.21
372.7861633	100.00
373.7970581	4.76
375.1510315	0.88
376.7034607	0.13
377.6373291	1.12
379.3482361	0.21
380.3755798	0.45
385.2584229	0.85
390.7454529	3.03
392.0469666	1.72
392.7369690	0.75
394.5007629	0.67
399.8515625	13.87
400.6722717	0.54
401.2991943	0.49
402.4512024	0.32
405.7849121	0.54
410.3784180	0.23
419.2233887	1.24
420.7453613	0.53
428.2532349	6.22
428.9892273	4.41
451.0135193	0.23
452.6950073	0.28
494.1017456	1.01
548.4246216	0.53
566.3324585	4.77
567.4481812	2.46
568.4028320	1.67
569.5089722	1.01
597.3901978	0.30
598.1393433	0.27
615.8394165	0.39
616.7971191	0.80
624.3283691	0.55
651.1838989	0.14
662.6153564	0.70
678.5441895	0.28
726.7590942	1.18
744.4991455	0.77
745.1603394	0.70
780.4013062	0.57
792.4558105	0.49
803.6992188	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	516.1956
Annotation	Unknow
Peak:m/z	Relative Intensity
150.0381470	1.20
152.1475525	0.31
171.3204651	0.62
182.9886169	0.51
186.9877319	0.35
188.2606201	0.36
199.0988312	0.30
205.0906219	0.30
217.9421082	0.36
249.0928497	1.02
250.1506653	1.29
251.3544159	0.26
253.2316284	0.43
263.1191406	0.27
267.4141846	1.15
273.2760010	0.18
275.2242432	3.88
277.1038208	0.14
283.4306030	0.20
292.2571411	8.98
293.2977905	3.69
310.2156982	18.77
312.3356934	0.33
314.2189941	0.34
315.5537720	1.13
321.2545166	1.04
329.2947388	1.27
334.6877441	0.66
335.6843262	1.09
336.3787231	1.05
338.5444336	1.08
343.3991699	0.15
344.9714355	2.45
352.1599731	0.22
354.3359985	12.17
356.3338623	0.51
358.8710938	1.22
359.5496216	0.71
361.3514404	0.34
376.2367554	0.18
383.1120605	0.16
384.1561279	0.14
387.2097168	7.65
399.2236328	0.86
400.4461060	1.27
401.2663574	1.87
418.5209961	0.32
424.8341064	0.49
425.9539795	1.10
429.3718262	1.57
435.3479614	1.53
436.4375610	1.60
443.3397827	44.45
449.5050659	2.53
454.4064941	1.63
455.3081055	8.86
468.1926270	0.45
472.2999268	100.00
473.1041260	0.08
475.0959473	1.63
477.3474121	0.43
481.1405640	0.29
483.5391846	0.21
487.3568726	0.22
488.0692139	0.40
492.7993774	1.50
497.0866699	0.84
498.3642578	2.53
499.1631470	0.26
501.2514038	0.46
502.2813721	0.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	332.1332
Annotation	5'-O-beta-D-Glucosylpyridoxine
Peak:m/z	Relative Intensity
96.0451660	0.01
99.9605484	0.01
105.9833832	0.03
107.9734497	1.60
123.0238266	0.01
124.2094421	0.09
133.1450043	0.02
134.1069641	0.41
135.9812012	1.59
137.0391846	0.01
137.8765259	0.04
145.0897217	0.06
149.8176575	0.01
151.9774780	4.89
154.0881042	0.14
170.1058960	7.55
189.9208984	0.01
191.1694946	0.02
206.0552673	0.02
214.1285400	0.06
234.3990479	0.04
237.9229736	0.03
245.1615601	0.04
248.2000732	0.02
250.0628662	0.04
254.2431641	0.01
268.0628052	0.06
272.1297913	0.01
296.0682068	0.19
314.2151489	100.00
315.4426270	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.25
Annotation	(3beta,5alpha,11beta,17beta)-9-Fluoro-17-methylandrostane-3,11,17-triol
Peak:m/z	Relative Intensity
107.1154633	1.86
108.9812927	2.71
116.861084	0.80
120.8868179	5.07
122.8854828	0.42
125.0668335	0.41
127.2089462	0.57
130.7550964	1.53
134.9784698	1.26
136.9529419	1.82
139.1848145	0.35
144.9289856	0.32
146.7019958	0.25
149.2585144	1.00
153.1697235	0.64
157.038147	2.45
159.008606	1.06
163.0105286	0.49
165.0913696	1.85
166.9180145	0.35
173.2086029	2.34
175.09021	0.36
177.2727356	0.65
178.7011566	1.78
183.0436554	2.97
187.1385193	2.84
189.3696899	2.06
191.041214	0.76
195.2981567	1.26
196.8209229	2.91
201.1141205	0.68
211.0485229	3.25
212.9361267	0.25
217.128479	0.52
219.0999756	0.35
221.9441528	0.31
233.2052612	1.56
238.8521729	0.49
247.151001	5.42
251.1738281	0.72
253.3171082	0.41
254.2389526	0.31
255.2870789	0.62
257.2614746	1.66
283.4921265	2.83
284.2417908	0.71
287.270874	0.38
297.3492126	1.09
298.4066772	0.25
299.2623596	4.27
300.1383362	0.31
302.8838196	0.45
305.263092	4.59
308.4645996	0.25
309.1262512	0.22
313.3801575	1.42
314.034668	0.84
321.1582336	0.87
323.2445679	100.00
323.925415	0.49
332.8376465	1.52
341.416687	0.83
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	457.1198
Annotation	12-chloroisoplagiochin D
Peak:m/z	Relative Intensity
142.6989594	0.04
161.0585022	0.13
179.0113068	0.76
281.0960388	0.07
293.3562012	0.12
295.2659912	0.50
341.1867065	100.00
365.2030945	0.26
383.3369141	0.10
393.0097961	0.11
411.4209290	0.04
439.5903931	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	364.79
Annotation	Unknow
Peak:m/z	Relative Intensity
186.2033386	0.06
196.9405975	0.36
212.8540344	20.92
264.2229614	0.06
280.8943787	100.00
292.2973938	0.08
296.8872070	42.30
305.2570496	0.47
318.2678833	0.08
319.1320190	0.50
328.0422668	0.13
336.0708313	0.14
346.2070007	7.79
347.0812378	0.95
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	566.2515
Annotation	Unknow
Peak:m/z	Relative Intensity
161.9904022	2.56
164.2298584	0.08
167.1896362	0.59
169.0610809	0.54
169.9153595	0.10
170.6766968	0.09
175.2436523	0.10
178.9329224	6.26
181.2807617	0.51
182.1205902	0.05
185.2292023	0.36
187.1656952	0.87
193.1655579	0.11
195.4096527	0.18
197.3391266	0.30
199.1682739	0.67
205.8091736	0.67
209.4516602	0.15
211.1205292	0.43
211.8564911	0.31
213.0418396	0.18
214.1933289	0.06
215.0902405	2.70
225.9176483	0.34
227.0865479	0.59
228.2274170	1.89
230.3671875	0.46
232.9900513	3.50
236.9042358	0.22
241.1102295	1.53
242.9489136	0.11
245.1014862	0.35
248.0727844	0.09
249.4700623	0.33
255.0691833	0.30
256.4620361	0.72
257.2924500	0.44
258.3455200	0.20
271.1463623	0.16
273.0975342	7.57
274.1886597	5.46
275.1741028	9.09
276.1776123	0.45
280.0526123	0.11
280.9909668	0.18
282.2789307	0.27
284.3135071	0.07
286.1485596	0.32
287.1940613	0.26
288.1862488	0.24
290.1743774	0.10
291.3163452	1.10
292.2344971	2.43
293.5512085	0.22
294.3401489	1.81
298.2821655	0.62
299.1002197	0.38
302.3602905	2.43
303.2648315	0.51
304.3078003	0.57
306.1814270	0.58
308.1301880	2.12
315.1131592	0.27
316.1903076	11.98
317.2215576	0.82
318.3576050	1.45
324.1046753	0.32
326.3742065	0.62
331.2286987	0.38
334.0021973	0.67
340.3081665	0.10
342.3601074	0.21
344.1605225	2.33
346.7509766	0.37
348.7111206	0.13
350.2606201	0.95
352.1589355	0.59
355.4168701	0.40
358.3223877	0.44
362.1210327	0.96
363.2388306	0.14
366.4858398	0.18
370.3414917	1.10
373.1970825	1.63
374.1359253	0.43
381.4127197	0.35
383.4778442	0.12
386.2676392	1.66
389.4619751	0.61
391.5297852	0.42
392.4474487	0.24
399.4689331	0.67
400.3386230	0.31
401.3043823	17.83
402.2985840	0.75
404.3139648	15.88
411.1654663	0.10
414.2924805	0.24
415.8053589	0.21
416.4253540	0.32
419.2917480	19.96
420.1199341	0.54
426.9330444	0.27
429.5285034	0.67
437.1376953	3.17
438.2851562	0.23
443.2905273	0.23
445.3117065	1.32
446.1100464	0.66
447.1307373	0.47
448.0132446	0.27
455.4884033	0.22
456.4739380	0.36
461.5211182	0.18
468.5695801	0.17
473.3526001	11.73
478.5419312	0.47
485.4714966	0.44
486.3032837	0.93
487.6197510	0.17
491.3111572	4.42
502.2683716	2.20
503.3594360	0.85
504.4613647	4.66
512.6123657	0.13
520.1109009	3.75
520.7236938	0.27
529.4163208	0.19
530.4368286	1.98
548.3718872	100.00
549.2103882	0.11
557.7985229	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	419.0982
Annotation	5,7,4'-Trihydroxy-3,6,8,3',5'-pentamethoxyflavone
Peak:m/z	Relative Intensity
136.9646454	4.71
137.5807190	0.04
142.9768372	0.05
149.1706848	0.05
151.0850220	0.11
157.0428467	0.14
160.9612427	0.04
162.9528503	0.06
164.9540405	0.07
178.9672394	0.36
189.0761719	0.10
190.9849854	0.12
193.2290497	0.05
209.2238464	0.05
221.0910187	0.14
235.1628113	0.09
239.0946045	0.53
251.0060730	0.06
256.2387695	0.12
259.2574768	0.07
271.3115845	0.18
281.1042480	100.00
291.1524963	0.03
297.2979431	0.04
298.9815979	0.05
315.0295715	0.07
317.3362122	0.04
323.1842041	0.13
325.1733704	0.09
329.2242126	0.15
331.4024658	0.24
333.8204956	0.09
339.3800049	0.09
342.3540649	0.02
343.1480713	0.10
346.3146362	0.08
357.0956726	0.26
358.3848267	0.06
359.5473938	0.09
361.0828552	0.24
371.9793091	0.04
373.1450500	1.01
375.2001038	1.00
377.2887268	0.31
383.1468506	0.03
384.0115051	0.06
389.1692505	0.17
391.2415466	0.05
392.0469055	0.02
399.2214355	0.07
400.4276428	0.07
401.3393555	0.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	337.1082
Annotation	Isowighteone
Peak:m/z	Relative Intensity
141.0918884	0.06
158.0419922	0.04
162.0476990	1.50
165.9687347	0.12
176.1323853	0.04
177.0311584	5.72
184.1442566	0.05
184.8543243	0.05
195.1077576	0.06
196.2684784	0.05
197.2640686	0.02
233.3389587	0.02
234.1420288	0.05
241.3016052	0.15
242.2971802	0.05
243.2471619	0.03
245.2958679	0.07
253.3060608	0.05
265.2619019	0.12
273.0988770	0.03
275.4281006	0.12
276.0407104	0.04
277.0307007	0.09
283.4364014	0.03
289.3009644	0.08
290.1512146	0.35
291.6969604	0.11
292.3446045	0.61
293.3057861	1.07
294.0998535	0.37
295.3914490	0.05
298.4166260	0.03
300.9981689	0.03
303.2254333	0.03
305.2409668	12.45
306.1941833	20.55
307.2653198	15.98
308.1405640	0.02
309.5062256	0.07
318.4287109	0.33
319.2161865	2.61
320.1784058	0.20
322.1619263	100.00
322.7723083	0.39
331.0930786	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	365.0513
Annotation	Phosphoribosyl-formamido-carboxamide
Peak:m/z	Relative Intensity
123.1448212	0.08
129.1187592	0.04
134.0687408	0.20
135.1352997	1.37
139.2258301	0.05
140.3733673	0.38
140.9812317	1.84
147.0374298	0.03
164.1469421	0.11
164.8561707	0.04
167.0896912	0.12
169.2395630	0.03
179.0133362	20.49
185.0578461	33.24
200.2698059	0.06
201.2351685	0.31
203.0229187	100.00
215.4638824	0.18
219.0540161	0.05
223.0466919	0.04
229.0644531	0.09
233.3326111	0.05
244.9837036	0.11
246.9739990	0.05
260.0425415	0.03
264.2473145	0.03
267.3722534	0.10
274.9828491	0.21
281.2120972	0.27
290.2857056	0.03
293.2158813	0.04
304.0782776	0.04
305.2655945	2.31
307.4290466	0.21
318.0449219	0.14
319.2049866	0.56
321.0615540	0.36
334.6405029	0.03
335.6983948	0.15
336.8128662	0.07
345.3107910	0.17
346.1909485	0.03
347.1924133	0.78
348.0187683	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	355.1013
Annotation	Scopolin
Peak:m/z	Relative Intensity
106.9060287	0.02
116.9803162	0.40
118.9430237	0.03
129.1060486	0.01
129.9918976	0.01
132.8520203	0.02
134.9580841	0.30
144.9613647	3.28
162.9573364	100.00
175.0128479	0.03
193.0785065	4.36
195.4693604	0.03
215.2029724	0.07
220.7568970	0.03
227.3428040	0.03
235.1142273	0.09
240.2480164	0.05
254.9637146	0.02
259.2800293	0.20
273.9049072	0.04
289.3195496	0.05
293.9039307	0.04
297.2839355	0.03
309.4322815	0.08
310.3048706	0.02
314.2746582	0.14
319.1498718	0.02
326.7449341	0.31
337.2155151	0.67
338.3887329	0.01
346.8305054	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	306.0766
Annotation	Glutathione
Peak:m/z	Relative Intensity
99.0157623	0.37
111.9495239	0.03
116.2580185	0.14
119.8744888	0.07
125.9742279	0.12
127.9040527	9.78
128.6803589	0.04
133.1005249	0.44
141.1048279	0.06
143.0860291	9.28
146.0933838	0.74
159.9739075	10.21
166.7855530	0.48
169.9916229	0.20
171.1892395	0.95
175.9682922	0.06
177.0905609	9.20
179.0686340	8.58
183.1781006	0.04
185.0674591	0.68
190.1468201	0.15
191.4478455	0.08
192.1467896	0.14
197.1982727	1.43
210.1531982	4.56
210.9759216	0.04
213.1120911	1.94
228.0755920	1.77
231.0559387	1.44
236.1517029	0.76
242.1682129	1.73
244.1499329	0.12
254.0932922	90.44
260.2822876	0.09
269.2091675	0.17
272.2136841	100.00
288.1785889	65.48
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	217.03
Annotation	Unknow
Peak:m/z	Relative Intensity
89.0527496	0.86
101.0763245	0.31
112.9203339	0.40
118.9827728	4.20
124.7008820	1.18
131.1184082	0.41
143.0923920	4.49
151.6213684	0.40
154.0402985	0.66
156.3813477	0.38
161.0221100	3.82
163.1251526	0.81
172.9314423	0.83
179.0680389	35.12
180.1611176	0.56
181.1306000	100.00
199.0260162	0.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	299.0772
Annotation	Pseudolaroside A
Peak:m/z	Relative Intensity
93.06837463	4.53
137.0197449	100.00
203.0108032	7.11
207.3106384	0.56
215.1949768	0.83
226.9642334	1.56
235.4407349	0.48
236.9563599	3.00
237.5986633	0.77
238.803894	0.67
251.0375671	0.52
253.0220032	23.52
255.1236877	1.62
269.3041687	0.73
281.3295593	2.72
299.4042969	1.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	589.067
Annotation	Unknow
Peak:m/z	Relative Intensity
216.4751587	0.27
225.1741943	0.47
254.2297668	0.30
260.9428101	0.59
277.0365601	6.26
288.8609009	2.29
295.1368713	1.98
303.2878418	0.62
304.9712524	0.69
305.7647095	0.39
307.0027466	13.34
318.9537964	2.77
321.1839600	0.31
324.9777222	0.55
330.8231812	4.04
336.9508057	7.23
343.0490723	0.55
346.8757324	0.65
364.3546753	0.25
365.9331055	1.03
367.0053711	30.73
367.6339722	1.25
373.2468872	0.90
378.8007202	0.64
382.1238403	2.83
383.2543335	0.40
384.9802246	0.22
386.3690796	0.73
391.0867310	6.66
394.9854736	0.38
396.9416504	16.41
408.5215454	7.92
409.1785889	64.81
415.3062744	0.83
425.0299072	0.28
426.3282471	10.46
427.1680908	100.00
499.1718140	2.06
511.3827515	0.48
528.9937744	1.12
544.1088257	7.55
545.0910645	5.30
565.6268921	0.69
570.1972656	3.94
571.1112061	9.23
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
115.0301819	4.94
116.0739136	1.06
131.0403748	0.37
132.0320740	0.12
145.0486145	0.01
156.3742981	0.01
158.9395294	100.00
159.9251404	26.13
160.8578949	0.02
176.5615234	0.01
181.8417969	0.02
183.1778259	0.01
185.9845428	0.01
198.9470825	1.38
200.0093994	0.91
200.8507385	0.04
202.0365601	0.04
217.0195923	0.75
218.0392456	0.58
228.9826050	18.90
229.9429016	12.66
231.2299194	0.02
244.4705200	0.13
245.2117310	0.33
246.0911560	0.19
247.1109314	0.01
260.8182373	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	727.5078
Annotation	Unknow
Peak:m/z	Relative Intensity
208.0438843	0.35
209.2194061	0.09
213.9266510	0.23
216.0485992	0.28
218.1925049	0.38
219.2786560	0.49
220.3480072	0.17
224.9815674	0.59
226.2325287	1.12
227.1754761	0.45
231.2835846	1.11
232.2155609	0.83
233.1497040	0.94
237.3014984	0.64
239.1436157	2.03
240.3311615	0.30
242.1597900	0.18
243.1447754	1.39
247.1643066	1.07
248.4137421	0.18
251.1337433	0.67
252.2763977	0.30
253.2782593	1.43
255.1974792	1.73
257.1752319	0.70
259.1913147	0.51
261.3591614	1.54
263.3217163	0.48
264.2841797	0.22
265.2314758	1.49
266.0473328	0.16
267.2650146	2.02
268.1763000	0.91
269.1506348	1.49
273.1515503	0.69
275.0846252	1.00
277.6221313	1.36
279.2026978	3.63
281.6819458	0.55
282.3980103	0.40
283.3119507	0.76
287.2842712	0.66
289.2877197	0.77
290.3900452	1.70
291.2657166	2.83
292.3489380	1.25
293.4143677	1.82
295.1113892	0.99
296.0832825	0.34
297.1680908	0.21
299.3054199	0.53
300.2196045	0.15
301.1000366	0.88
302.0513306	0.66
303.1102295	1.35
304.1285400	1.19
305.5304871	2.64
306.2222290	0.44
307.1040039	1.21
309.3662415	2.58
310.5882263	0.41
311.2854004	0.35
313.0676880	0.12
314.6862488	1.55
315.4948425	1.00
316.9364014	5.19
317.6089478	0.34
318.3046265	1.17
318.9742432	0.30
320.2690430	1.25
321.3798218	1.92
322.5733032	0.61
323.3820801	0.78
325.3797607	1.01
326.8478394	2.12
327.4995117	0.90
329.3039551	5.49
331.2902222	3.22
332.1826782	1.34
333.0886841	3.37
334.4344482	0.62
335.3062134	4.72
337.2893066	0.86
338.1888428	0.45
338.8892822	0.56
339.5854492	0.87
340.5169373	0.94
341.3749390	2.38
342.6879272	0.87
343.5144043	2.09
344.2238159	0.70
345.3604126	6.21
346.4475098	0.57
347.2359619	0.83
348.2997131	1.70
349.1253662	2.75
349.8867188	2.94
351.2243042	0.26
353.4251099	0.77
354.2196655	0.41
355.3633423	3.00
357.2302551	3.92
358.5560913	1.81
359.2672424	2.33
360.2074585	0.30
361.3389893	3.73
363.3146973	3.19
365.3559570	2.08
367.5401001	1.10
369.1575928	3.79
370.3123779	0.95
371.2183228	4.90
372.3585815	1.02
373.3593750	1.79
374.1514282	0.45
375.3294067	2.27
376.4686890	0.50
377.7293701	1.90
379.2133179	1.77
380.3048706	0.88
381.2877808	3.35
383.2111206	4.05
384.4290771	1.17
385.4266968	4.66
386.3035278	0.89
387.3505249	3.22
388.1887207	1.68
389.4150391	0.76
390.6828003	2.46
391.5319214	5.26
392.5933228	0.96
393.5339966	2.41
394.3192139	1.30
395.4157715	1.80
397.2949829	1.93
398.5529785	0.51
399.5756836	2.32
401.3056641	3.01
402.8687134	0.71
403.6487427	2.35
404.6672974	0.59
405.4035034	2.61
406.6839600	0.24
407.2893677	0.78
408.4713135	0.62
409.2182617	2.06
411.3150635	1.36
413.5905762	0.53
414.4617310	2.88
415.3658447	2.93
416.2978516	2.57
417.3712158	4.07
419.3933716	3.14
420.3970337	1.36
421.5325928	2.47
423.3098145	3.57
424.4179077	0.82
425.7413940	0.99
426.6312256	0.39
427.5129395	2.37
428.3016968	2.70
429.4320068	3.66
430.6290283	1.06
431.5045776	5.63
432.2013550	0.61
433.5227661	5.96
434.4506226	0.77
435.3404541	3.29
436.2629395	0.13
437.4805298	0.57
439.5700684	1.56
440.5498047	3.97
441.4783325	4.12
442.5708008	0.86
443.4884033	6.96
444.4852905	1.89
445.5670776	4.19
446.4862671	1.78
447.3881836	7.40
448.4726562	0.93
449.4935913	2.85
450.5673828	0.29
451.5513916	3.94
452.4324951	0.79
453.3580322	4.45
454.3491211	1.23
455.3638916	4.48
456.4685059	3.11
457.3729248	8.23
458.2540283	1.98
459.3778076	7.48
460.3372192	1.82
461.5637817	3.62
462.4857178	1.55
463.4972534	4.84
465.3850708	5.88
466.4748535	0.42
467.4481812	2.45
468.4336548	1.33
469.4964600	7.38
470.8002930	3.54
471.5212402	7.41
472.4005737	2.72
473.4727173	6.82
474.4413452	2.02
475.4373169	5.29
476.1002808	0.27
477.5011597	4.03
479.4473877	1.48
481.4557495	6.00
482.4433594	0.89
483.4533081	6.59
484.3988647	1.70
485.4373169	3.11
487.3828735	9.53
488.2189331	2.16
489.4545288	6.82
490.4833374	1.72
491.3685913	3.84
492.6254272	0.22
493.6200562	0.47
495.4889526	2.81
496.4406738	0.44
497.4656372	3.32
498.3663330	0.88
499.4675293	4.16
500.4783325	3.58
501.5361328	11.40
503.5101929	4.33
504.7160034	1.47
505.6185913	1.82
507.6107788	4.62
509.3786621	1.56
510.7313843	2.30
511.5267944	4.26
512.3323364	0.46
513.3960571	4.98
514.2982788	0.60
515.4132690	4.44
516.3631592	0.35
517.5305786	5.05
518.3998413	0.68
519.1015015	0.60
519.7058716	2.04
521.5917358	1.44
522.8917847	1.02
523.6391602	1.50
524.5248413	0.19
525.4766235	5.20
526.8483887	0.57
527.6365967	3.54
529.5328979	5.76
530.7499390	0.81
531.6029053	1.63
532.6360474	1.08
533.5602417	2.29
534.4623413	1.34
535.5764160	2.98
536.5683594	0.88
537.8890991	2.12
538.5143433	0.23
539.5515747	4.15
540.8977661	2.66
541.5523682	4.24
542.5791626	3.21
543.4987183	9.73
544.6671143	3.10
545.4308472	5.36
546.5355835	0.12
547.6101685	3.54
548.3614502	1.14
549.6107178	2.16
550.5132446	0.42
551.9185181	0.51
552.8092651	0.66
553.6688232	3.33
555.3703613	6.43
557.6200562	7.00
558.5704956	0.48
559.6456909	7.34
560.6444702	2.50
561.7399292	5.92
562.7666626	0.33
563.7565918	4.99
564.9859009	1.64
565.7851562	1.82
566.7731323	2.43
567.7455444	3.60
568.4824829	0.66
569.5194702	7.27
570.4396362	2.42
571.6310425	9.85
572.5679321	2.79
573.5706177	11.74
574.5247803	1.31
575.6002197	3.55
576.5808105	0.64
577.2358398	0.22
577.8721313	1.04
579.4963379	1.49
581.5977173	12.50
583.3974609	15.34
585.4568481	15.52
586.6139526	1.45
587.5933228	4.48
588.7386475	2.85
589.7438965	2.27
590.5281982	0.21
591.5319214	2.06
592.6296387	0.77
594.4072876	0.30
595.6492310	2.39
597.0034180	1.89
597.7206421	4.92
599.4807739	58.68
600.5157471	6.05
601.5745239	23.93
602.4333496	0.97
603.5585327	1.18
604.3878174	0.42
605.6940308	2.90
607.5991821	2.18
609.8327026	1.60
611.4404297	8.62
612.3997192	0.42
613.6581421	2.14
614.8109741	2.74
615.5654907	9.81
616.6087646	1.93
617.6079102	3.11
621.6961670	1.11
623.7385254	0.15
624.3969116	0.26
625.6760864	2.92
628.4620972	11.25
629.6165161	7.24
631.4912109	0.26
633.6484985	0.25
634.5122070	0.68
635.7275391	0.57
638.6201172	0.27
639.6992798	0.16
640.4856567	0.53
641.7080688	1.00
642.5863037	2.92
643.6734619	3.88
646.5328979	0.35
647.7380371	0.27
652.1807251	0.54
653.5612183	9.31
654.2274780	0.81
655.5980835	3.51
656.6132202	0.54
657.7439575	3.22
658.6385498	0.32
659.5848999	1.33
663.6127319	2.17
665.6238403	0.68
667.7185669	2.30
669.6586914	1.28
670.5703125	3.39
671.6642456	51.42
673.0426636	2.14
681.0065918	1.32
681.7588501	10.38
683.6280518	4.39
684.9157104	2.55
685.6259766	1.23
686.5920410	0.33
687.5939331	0.71
691.7295532	9.50
696.5922241	1.13
697.6550903	4.22
698.7702026	6.64
699.7666626	35.44
700.9088135	0.65
709.6447144	100.00
710.4907227	1.68
711.4097900	0.43
712.7664795	0.78
727.1262817	0.65
730.3126831	0.51
733.4393311	0.76
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	359.1345
Annotation	Semperoside
Peak:m/z	Relative Intensity
111.0543976	0.07
119.0669861	0.05
135.1492920	0.07
139.2254639	0.06
142.4593811	0.15
143.1486206	0.09
145.0296326	0.03
146.9206238	0.11
149.1518555	0.09
153.0286865	14.24
160.3711700	0.25
161.0063782	0.45
173.1280975	0.05
175.0858459	0.07
178.7692413	0.44
181.3227539	0.09
188.2633972	0.07
190.9994202	0.11
193.1277161	0.08
195.2865143	0.39
197.0628204	100.00
199.3671875	0.03
207.2655029	0.38
210.9776611	0.12
215.2895203	0.09
217.4313049	0.07
231.1854553	0.05
236.9288635	0.07
239.2259216	1.14
241.2952271	0.04
243.3634033	0.12
244.3905334	0.06
249.2288208	0.05
250.4086914	0.03
251.1795959	0.05
254.2432251	0.15
255.3022766	0.10
258.9563904	0.10
260.2288818	0.06
269.0568237	2.03
271.0216370	0.60
283.2133179	0.19
284.0721130	0.25
286.8969421	0.39
297.1876831	0.23
299.1445312	1.58
300.9643555	0.59
303.2265625	0.16
311.0365295	0.14
313.1434326	1.64
314.4763184	0.25
315.1783752	0.60
317.1354370	0.03
322.9935608	0.42
327.2379150	0.05
328.2883301	0.24
329.1741943	0.16
331.2550964	0.14
337.0569763	0.20
340.3504333	0.50
341.2415466	1.23
343.2716370	0.11
344.4049683	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.1091
Annotation	Lactulose
Peak:m/z	Relative Intensity
96.9054413	0.39
98.9361572	0.17
101.0179749	8.94
106.7219086	0.63
112.9570007	19.01
118.9723511	9.26
125.0558624	2.13
130.9962311	6.82
135.0445099	0.13
143.0625916	22.06
149.0063171	3.00
160.9846191	22.00
178.9813538	100.00
179.9658508	0.18
193.1454468	0.46
221.1091919	0.10
267.0578613	0.41
280.9456482	1.88
291.3089905	0.28
322.2669678	0.11
323.2177429	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	709.4972
Annotation	Unknow
Peak:m/z	Relative Intensity
200.0679626	0.22
203.2709656	0.65
205.1974182	0.53
206.2087097	0.45
206.9493256	0.26
213.0519562	0.82
215.1818085	1.23
217.2837524	1.33
218.2039337	0.80
220.3648376	0.50
221.1028442	1.65
223.0292969	0.76
227.0047760	0.31
229.0843201	0.49
230.2362518	0.20
230.8636169	0.58
232.6041565	0.52
233.2419128	0.39
234.1540222	2.17
235.3795013	0.71
239.1203766	1.61
240.2519073	0.36
241.2631226	0.76
242.1676941	1.18
243.4577637	2.72
248.2570648	0.36
249.2672424	1.03
252.1818237	0.94
253.2450714	2.89
254.3540344	0.40
255.1442871	2.71
257.0682068	1.36
258.0466919	0.30
259.2671814	2.42
261.1549683	0.86
263.2551270	3.02
264.3905945	0.69
265.3158264	4.96
267.3102112	1.97
269.1645813	5.37
270.3396301	0.43
271.0410156	0.14
273.1017456	1.09
274.0626831	0.60
275.2369385	0.61
276.3168945	0.43
277.2946472	1.25
279.2379761	1.65
280.1656799	1.14
281.2621460	2.90
282.5272827	0.48
283.2833557	0.77
284.8155518	1.60
287.3034363	0.67
288.8925171	1.59
289.5247192	0.26
291.1666870	2.31
292.2138977	2.81
293.1835632	1.28
294.4287720	1.66
295.2143555	2.63
296.2349854	1.04
297.3172913	0.46
298.4530029	0.94
299.5845032	1.87
300.2050171	0.24
301.2673340	2.12
302.1455078	0.28
303.2583618	1.29
304.4342041	4.29
305.4114990	2.42
306.3339233	1.21
307.4254150	3.23
309.3604431	2.20
310.6823120	1.72
312.4701233	1.18
313.3949890	3.33
315.0057373	5.37
316.2367554	2.00
317.2180786	3.49
318.3794556	2.57
319.4288330	2.56
320.3557739	1.47
321.3651123	1.84
322.3230896	1.80
323.3618774	0.78
324.1049805	1.13
325.1453247	0.92
327.2654419	1.15
328.1622925	1.62
329.2713318	8.39
330.2288208	5.93
331.3997803	3.36
332.3857422	0.56
333.2396240	6.68
334.3148193	0.89
335.2305298	2.90
336.4431152	1.63
337.6393433	2.56
338.5209045	0.89
339.4340210	3.54
340.1993713	2.46
341.2246094	1.41
342.1873169	1.46
343.3023987	2.22
344.3062134	1.59
345.2000122	7.32
346.7457886	1.51
347.3474731	1.23
348.2991333	0.44
349.0612793	0.38
351.0948486	0.33
352.5636597	2.04
353.4179077	4.56
354.3334961	2.06
355.2706909	9.70
356.2420044	1.77
357.4012451	3.61
358.3543701	2.70
359.1520386	3.47
360.3024292	3.95
361.4287109	6.38
362.4713745	0.79
363.3166504	3.19
364.1071167	0.80
365.3338623	2.95
366.3723755	2.18
367.2734985	2.50
368.3414917	3.75
369.3786621	7.69
370.2750244	4.43
371.3919067	6.18
372.4338989	1.33
373.4064331	8.92
374.2223511	3.30
375.1952515	4.49
376.3818970	0.68
377.4794922	2.27
378.5213013	3.16
379.1758423	1.51
380.4386597	1.89
381.2813110	4.61
382.3750000	1.35
383.8017578	3.26
384.6209106	1.42
385.4228516	3.71
386.3102417	5.98
387.5456543	5.45
388.4468384	2.40
389.3930054	6.65
391.4221802	2.42
392.7156982	0.45
393.5617065	3.47
394.3387451	0.78
395.4120483	3.94
396.5060425	0.52
397.3959961	4.44
398.3659058	5.16
399.2948608	6.21
400.3267212	2.51
401.4053345	3.02
402.4529419	0.84
403.4541016	7.86
404.7158203	0.39
405.4907227	7.68
406.3720093	0.80
407.4122925	4.04
408.2897949	0.97
409.5303345	5.40
411.5803833	0.49
412.4515381	1.95
413.4011841	7.79
414.3675537	2.81
415.4666138	6.59
416.3320923	5.63
417.5752563	6.09
418.3854370	4.03
419.4658203	3.16
420.2343750	1.04
421.3652344	3.99
422.8824463	3.12
423.5173950	0.17
424.6766357	1.83
425.4758301	4.73
426.3527222	3.05
427.5028687	4.62
428.6657104	4.81
429.4068604	11.83
430.5270386	3.55
431.4370117	3.50
432.4829712	2.96
433.5172729	4.53
434.2113037	2.42
434.9505615	0.35
435.6015625	1.09
436.2440186	0.68
437.3521729	1.98
438.3439331	2.32
439.4938354	9.87
440.6447754	4.00
441.4985962	7.77
442.4960327	11.73
443.4832153	18.56
444.5228882	8.74
445.4659424	3.45
446.2404175	0.78
447.3375854	2.41
448.3528442	1.84
449.4157104	2.09
450.8147583	1.20
451.5051270	3.78
452.8237915	1.98
453.4709473	4.62
454.4308472	4.45
455.4638672	12.45
456.4321899	7.47
457.4658813	11.82
458.4285889	7.35
459.3430786	8.35
460.4751587	2.39
461.6092529	1.51
462.4254150	2.87
463.6026611	1.63
464.3743286	1.26
465.5372314	7.90
466.4438477	2.31
467.4761963	10.62
468.5211182	7.67
469.4313354	13.13
470.4330444	5.00
471.5593872	12.59
472.5802002	4.88
473.5911865	6.80
474.5277100	0.75
475.5814819	4.10
476.4535522	2.76
477.5427856	1.74
478.4174805	1.44
479.5499268	5.63
480.4634399	4.66
481.4365234	2.79
482.4301147	8.21
483.4325562	21.26
484.4925537	11.41
485.5071411	5.31
487.2222290	5.87
488.0744019	1.36
489.4898071	2.93
490.5650635	1.07
491.6817627	1.94
493.5441895	8.56
494.6831665	4.67
495.5399170	5.52
496.3701172	0.69
497.5267944	14.12
498.5287476	4.76
499.6015625	9.44
500.3712158	3.90
501.4998779	4.91
502.5468750	0.96
503.6201172	7.07
504.7316895	2.02
505.5836182	1.48
506.6353149	3.30
507.5982666	3.03
508.5078735	0.45
509.5553589	4.31
510.6213379	1.80
511.6029053	15.69
512.6401978	4.34
513.5448608	9.92
514.6887817	4.88
515.5565796	7.20
516.5140381	2.43
517.6505127	3.90
518.5264282	2.92
519.5057373	4.29
520.4428711	0.35
521.5467529	5.17
522.5007935	0.64
523.5291138	4.08
524.8290405	5.44
525.6186523	10.38
526.7197876	8.30
527.5852661	12.01
528.4915161	2.49
529.4423218	6.68
530.4459839	4.57
531.5526733	2.78
532.5338745	2.93
533.7285767	3.13
534.5950317	0.74
535.5383911	1.79
537.0390625	4.69
537.7288208	3.38
538.4710083	3.88
539.5309448	14.78
540.5697632	11.94
541.6163940	10.30
542.4437866	9.35
543.5315552	13.37
544.5834351	7.58
545.7033691	5.30
546.7423706	1.58
547.5388794	0.74
548.7936401	1.50
549.6260376	1.93
550.6648560	1.43
551.6225586	3.93
552.6386108	5.51
553.6530762	19.18
554.6473389	15.86
555.5593262	22.60
556.7327271	8.34
557.5353394	9.15
558.6771851	5.93
559.6154175	2.48
560.4848633	1.24
561.4675293	4.05
562.5527954	1.57
563.5035400	5.75
564.6453857	4.22
565.5492554	16.92
566.3402710	6.55
567.4933472	36.71
568.5725708	12.99
569.5368042	17.67
570.4877319	11.98
571.5791626	6.85
572.6660767	2.33
573.6196899	1.52
574.5123901	0.62
575.7688599	2.08
577.8585815	1.20
578.5957031	2.83
579.5609131	7.99
581.5221558	100.00
582.5535889	42.00
583.5756836	50.12
584.5941772	21.31
585.7156982	4.58
586.7230835	2.16
587.6608887	2.08
588.7260132	0.24
589.5096436	1.15
590.6146851	0.71
591.5350952	1.23
592.5938110	10.38
593.6573486	15.17
594.5653687	5.87
595.6099243	11.44
596.5959473	10.58
597.6157837	35.00
598.5148315	7.31
599.4943237	2.16
600.3015747	1.96
600.9401855	2.20
601.6309204	0.22
603.4428101	0.51
604.9588013	0.34
605.8268433	1.62
606.4960327	2.24
607.6912231	4.74
608.8065186	3.76
610.3950806	41.43
611.5054321	49.26
612.5360718	22.58
613.6316528	7.03
614.5531006	1.37
615.7775269	0.53
617.5704346	0.60
618.5472412	0.44
619.6260376	1.41
620.4672241	1.18
621.6237793	1.29
622.3634033	1.44
623.5527954	5.59
624.5460815	8.72
625.6257935	26.30
626.7089233	4.55
627.6637573	4.16
628.7416382	1.96
629.4159546	0.55
630.4252930	1.41
633.7418213	0.57
634.4163208	1.08
635.8500977	2.59
636.7448730	2.48
637.7207642	3.51
638.7601318	3.77
639.5899658	10.04
640.7725220	7.48
641.6226196	3.72
642.8643799	3.20
643.7762451	1.42
644.6196899	0.76
645.6578979	0.69
647.7318115	1.94
648.6068115	0.44
649.7171021	0.79
651.6418457	5.45
653.5068970	84.96
654.5974121	33.77
655.5756226	4.72
656.5341187	0.46
661.6575317	0.54
663.6142578	12.20
664.7952271	7.09
665.8886108	3.85
666.7501221	3.10
667.7308960	9.51
668.6918945	4.60
669.7521973	3.11
673.3850708	2.39
674.6744995	1.93
676.7207642	0.24
677.6244507	0.41
679.7537231	9.70
680.8751831	19.68
681.6627197	64.73
682.7124634	34.82
684.6508789	0.75
689.6458740	0.43
691.6925049	87.26
692.7426147	41.55
694.5883179	1.76
695.5911255	0.93
697.1633911	0.26
707.4674683	1.70
708.3604126	0.16
709.6396484	7.76
710.7659302	0.96
711.6892700	0.84
713.6363525	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	489.0011
Annotation	Unknow
Peak:m/z	Relative Intensity
241.1605377	0.60
243.2826691	0.04
255.3864441	0.06
257.0759583	0.05
262.1455688	0.10
296.9789429	0.04
320.9410400	0.46
354.5713806	0.10
357.0813904	0.15
399.0692749	0.12
409.1739502	100.00
425.2801514	0.12
427.2123718	0.22
445.7064819	0.19
471.2853699	0.56
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	365.0515
Annotation	Phosphoribosyl-formamido-carboxamide
Peak:m/z	Relative Intensity
114.8814545	0.04
135.1308594	2.19
139.1244202	0.08
140.2433929	0.19
141.0153809	1.43
161.1744690	0.06
179.0899811	17.31
185.0266418	32.92
186.0946198	0.08
187.1355896	0.03
203.0464478	100.00
214.2647400	0.04
215.0305939	0.06
216.6705627	0.04
217.2957611	0.07
243.0711060	0.10
246.0294495	0.02
249.9943237	0.09
262.8461304	0.04
269.1408691	0.14
272.0977478	0.05
275.1778564	0.16
277.3589172	0.05
281.2799072	0.31
282.2659302	0.04
292.2592773	0.04
292.9229736	0.02
303.2538452	0.14
304.4087524	0.10
305.1253967	0.49
319.2649231	0.25
320.8552246	0.23
322.4695435	0.04
328.7888184	0.03
334.9386597	0.08
337.5356445	0.03
345.5294495	0.33
346.4236145	0.16
347.3057556	0.48
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	336.859
Annotation	Unknow
Peak:m/z	Relative Intensity
102.8991547	0.98
145.1112671	0.04
146.8935242	15.01
172.7906342	0.10
189.0297089	0.37
190.8716583	100.00
191.9289246	0.17
192.9926758	0.19
218.8551941	0.06
245.1951904	0.04
248.5584717	0.05
249.2264404	0.05
251.7823181	0.02
262.9074402	6.55
279.7789001	0.47
280.9237366	0.19
290.8402710	0.67
292.8420410	68.93
304.9769897	0.05
308.7164307	0.02
318.7875977	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1253.0382
Annotation	Unknow
Peak:m/z	Relative Intensity
427.3325195	0.12
534.6794434	0.06
555.1785889	0.06
645.5343018	0.14
694.4686890	0.13
736.4693604	0.20
742.1373901	0.28
754.6191406	0.13
811.4069824	0.19
830.3040771	0.56
908.2363281	0.29
920.2243652	0.23
942.5644531	0.85
948.9018555	0.05
951.1235352	0.30
959.5892334	0.33
969.0728760	0.11
975.7716064	0.17
978.6612549	0.10
981.9881592	0.10
985.6027832	0.16
991.1840820	2.66
991.7933350	1.42
994.6901855	0.31
995.4158936	0.18
999.8391113	0.77
1008.8245850	1.56
1009.5393070	0.10
1017.3511960	0.75
1020.9315190	0.39
1025.2191160	0.19
1026.5469970	0.13
1029.6873780	1.61
1034.1689450	0.43
1038.4819340	1.41
1039.3054200	0.19
1040.2961430	0.20
1047.4251710	5.63
1048.3585210	0.13
1049.4233400	0.05
1051.0739750	0.16
1051.8305660	0.05
1056.2902830	0.37
1057.2637940	0.51
1060.0190430	1.07
1060.7614750	2.21
1064.6346440	1.52
1065.5826420	0.11
1069.3659670	26.66
1070.1733400	1.71
1074.5672610	0.58
1078.3140870	16.53
1079.2414550	3.15
1083.2916260	0.26
1086.5581050	5.16
1087.2972410	5.25
1092.5612790	0.25
1095.7607420	3.52
1096.3651120	0.64
1099.6329350	0.19
1108.8417970	0.89
1111.6005860	0.25
1112.9628910	0.18
1117.4890140	1.72
1118.4019780	0.79
1126.7241210	2.49
1127.5469970	0.30
1135.0765380	1.72
1136.0068360	1.61
1138.7191160	0.20
1139.6816410	0.36
1144.2265620	0.28
1145.2724610	0.64
1148.2529300	6.80
1149.1341550	0.78
1151.2213130	0.09
1157.3352050	18.36
1158.1843260	0.24
1161.6186520	0.57
1166.3640140	13.42
1167.2058110	1.16
1168.0566410	0.17
1169.1960450	0.08
1170.3464360	0.21
1175.8244630	0.17
1179.2717290	0.09
1188.0369870	0.51
1191.4597170	0.28
1195.1584470	0.11
1198.1496580	0.45
1198.8685300	0.15
1204.1391600	0.71
1204.7864990	0.63
1213.2924800	5.44
1214.1809080	1.36
1217.2208250	0.69
1218.2868650	0.11
1220.2711180	1.92
1221.0897220	0.52
1222.4001460	6.78
1223.2097170	0.44
1226.3297120	28.02
1227.2386470	1.17
1227.9616700	0.48
1229.0843510	0.65
1229.6871340	0.77
1230.5938720	0.18
1231.5612790	2.86
1232.8796390	0.29
1235.3879390	100.00
1236.2573240	3.64
1237.3834230	0.67
1293.4031980	0.09
1320.0432130	0.04
1336.6250000	0.11
1420.6549070	0.14
1476.0786130	0.70
1476.7811280	0.19
1493.9906010	0.23
1510.7264400	0.26
1520.2646480	0.08
1522.0863040	0.12
1666.0532230	0.24
1668.0227050	0.05
1685.8049320	0.13
1733.6973880	0.13
1752.1007080	0.22
1790.8038330	0.09
1833.8221440	0.08
1868.1311040	0.07
1871.8656010	0.07
1880.9876710	0.10
1903.9587400	0.03
1915.8410640	0.09
1920.5814210	0.07
1947.5949710	0.22
1954.2098390	0.06
1962.8209230	0.05
1969.7022710	0.05
1972.9649660	0.08
1977.3679200	0.05
1980.5635990	0.10
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
89.8000259	0.01
135.9653320	20.89
146.9952545	0.06
152.7947845	0.01
158.8000946	0.03
165.0164642	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	299.0771
Annotation	Pseudolaroside A
Peak:m/z	Relative Intensity
92.99316406	5.61
119.1628723	0.57
137.0261993	100.00
155.34021	0.55
166.140564	1.61
168.8558502	1.07
193.0282288	1.64
201.3403015	0.79
202.9896851	6.38
205.1049805	2.80
207.1756592	2.33
213.1090088	0.60
227.375061	0.41
231.2021484	1.40
239.2377625	1.92
242.071991	3.50
253.0789185	28.08
255.008606	4.53
267.2263184	0.58
271.3394775	1.02
279.2073975	2.58
281.1133728	6.56
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	478.2943
Annotation	PC(15:1(9Z)/0:0)
Peak:m/z	Relative Intensity
152.9511414	0.39
154.9512939	0.10
183.3082428	0.03
196.0918884	1.07
208.9721985	0.13
213.2776947	0.06
214.1466980	0.77
232.2128448	0.06
239.8931274	0.13
264.1411743	0.06
267.0810852	0.10
281.2927246	100.00
281.9351501	0.48
297.2603455	0.17
329.2715149	0.18
351.0214233	0.06
383.1487427	0.14
397.4585876	0.10
398.7322083	0.33
399.4621887	0.11
404.6826477	0.21
413.6595764	0.19
417.3352356	0.34
418.0180359	0.11
424.2998962	0.10
431.2707825	0.12
433.9651794	0.23
434.7101135	0.20
435.5406799	0.22
437.5715332	0.09
442.2246399	0.14
446.4980164	0.21
459.5916443	0.86
460.6903687	0.05
461.3856201	0.33
462.5744019	0.19
477.5837097	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	939.46
Annotation	Unknow
Peak:m/z	Relative Intensity
303.1683350	0.16
550.2659912	0.17
627.4193726	0.32
680.6488647	0.62
755.5968628	0.71
779.1058960	0.48
785.3288574	3.69
790.5328979	0.92
796.2110596	0.25
851.6213989	0.57
885.8632812	0.28
889.1199341	0.59
904.6862183	1.18
927.0481567	0.96
928.1736450	0.83
978.6373901	0.60
990.8340454	1.04
992.3945923	1.38
993.1582642	0.92
1015.9208980	1.25
1046.9437260	9.20
1048.1359860	0.19
1061.6486820	1.19
1071.4865720	0.61
1128.7536620	3.21
1130.4821780	0.42
1137.7583010	0.91
1164.5510250	0.62
1169.0360110	0.84
1181.6166990	0.34
1185.8081050	0.27
1275.5133060	2.55
1304.5303960	0.85
1342.9959720	0.73
1380.0566410	0.21
1423.8726810	0.60
1494.0130620	0.22
1524.9902340	0.17
1627.1867680	0.34
1633.9216310	0.21
1657.9910890	0.86
1660.6571040	0.18
1684.2523190	0.17
1690.9263920	1.04
1695.7088620	0.32
1699.1578370	0.64
1708.1623540	0.31
1709.8734130	0.60
1729.5614010	0.19
1730.7009280	0.27
1735.6695560	0.44
1736.2707520	0.41
1739.0114750	1.09
1742.9608150	6.85
1756.0847170	2.23
1759.7672120	0.71
1760.5926510	0.25
1763.5330810	0.61
1766.0860600	0.19
1769.2072750	0.56
1771.2806400	0.19
1778.0819090	0.52
1784.1384280	2.07
1785.5328370	0.50
1787.6453860	0.41
1789.2005620	1.15
1802.2039790	1.09
1803.2452390	0.21
1804.3385010	1.40
1811.6110840	0.97
1818.7525630	0.32
1819.8072510	0.44
1825.0411380	0.86
1826.7537840	0.42
1836.4166260	0.26
1838.2244870	12.72
1841.8275150	1.73
1847.0252690	0.32
1848.1414790	16.51
1850.2357180	0.39
1851.2375490	0.26
1851.9097900	0.22
1852.5897220	0.25
1854.1839600	0.50
1854.9372560	2.07
1857.6560060	2.90
1860.1968990	0.67
1862.7191160	1.46
1863.6461180	0.53
1864.4395750	0.16
1865.2291260	0.63
1870.3343510	0.76
1874.0051270	0.34
1875.5606690	2.07
1877.0548100	0.29
1881.1848140	0.71
1882.8244630	8.06
1883.7977290	0.47
1887.0501710	0.14
1889.9930420	10.96
1892.3668210	3.74
1894.3199460	1.56
1895.5876460	40.06
1896.3201900	3.35
1897.5018310	0.16
1898.5848390	0.17
1900.4611820	0.88
1901.4118650	0.29
1902.3114010	0.57
1903.0677490	0.35
1904.0197750	0.54
1906.0866700	0.54
1906.8890380	1.58
1907.7740480	2.34
1909.2126460	0.21
1910.0250240	0.78
1911.1951900	0.36
1912.6007080	12.99
1914.0592040	1.93
1915.2586670	0.14
1915.9992680	0.31
1917.0504150	3.40
1920.9031980	0.32
1921.8939210	0.22
1924.0977780	0.33
1924.8239750	9.71
1925.5612790	0.28
1926.1793210	1.00
1927.5113530	31.70
1929.0404050	1.38
1930.3693850	0.56
1931.4328610	0.27
1932.7933350	1.08
1933.9803470	0.31
1935.0819090	1.23
1936.6016850	0.16
1937.4761960	1.21
1938.3489990	3.15
1940.1307370	4.95
1941.0222170	14.15
1941.7561040	1.20
1943.4586180	0.86
1944.2113040	0.74
1945.1160890	0.46
1945.8522950	1.10
1947.8145750	44.70
1948.9279790	13.50
1950.6613770	0.37
1951.4322510	53.98
1952.4602050	0.21
1953.2043460	1.98
1954.3298340	32.62
1955.0777590	11.06
1955.8919680	1.87
1958.0682370	0.19
1959.1026610	14.56
1960.0948490	2.59
1961.0593260	2.67
1961.9201660	1.83
1963.7257080	3.13
1964.4665530	0.52
1966.1848140	2.84
1967.1971440	0.68
1969.0007320	22.09
1969.7984620	1.60
1970.5797120	1.63
1971.2911380	2.26
1972.5902100	23.77
1973.6983640	0.62
1974.6641850	16.69
1975.3521730	2.14
1976.3581540	11.07
1977.1573490	0.21
1978.4793700	100.00
1979.7266850	1.36
1981.4152830	38.49
1983.1881100	88.59
1984.1182860	2.44
1985.6354980	35.01
1986.7894290	1.18
1988.1188960	1.39
1988.8829350	0.94
1989.9007570	2.94
1990.6486820	2.15
1992.0565190	2.25
1993.2429200	57.26
1993.9479980	0.53
1995.0520020	1.31
1996.2022710	5.39
1997.2305910	2.09
1999.0821530	49.37
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	191.02
Annotation	Diketogulonic acid
Peak:m/z	Relative Intensity
84.9204102	0.33
86.8309631	1.04
110.9628448	100.00
127.1316071	0.04
128.9881744	2.05
130.8866882	0.67
137.1085358	0.15
155.0369263	0.63
172.9366608	20.98
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	333.06
Annotation	alpha-D-Galactosyl-(1,1')-sn-glycerol 3-phosphate
Peak:m/z	Relative Intensity
97.1105499	0.33
112.8323212	0.11
151.0555420	1.28
152.9131622	100.00
171.0747528	2.68
173.1420441	0.10
181.0542297	0.22
223.0344238	0.15
241.0490112	88.10
243.0083313	0.05
248.9512329	1.48
259.0533447	1.36
265.1115112	0.03
273.1088257	0.20
276.9778748	0.13
288.8898926	0.13
291.2223511	0.04
297.4796143	0.17
315.9087524	0.35
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	421.26
Annotation	spinosyn macrolactone
Peak:m/z	Relative Intensity
153.0937347	2.58
192.0477142	7.88
245.2294922	18.91
248.5859375	3.56
262.2591248	9.72
267.4621582	5.27
299.2745972	13.32
309.4354553	27.03
319.6741333	4.74
324.9309692	2.91
327.2329712	8.03
337.5005493	6.79
339.2225952	4.73
341.3382568	5.32
343.4806519	11.73
347.2706299	12.51
353.4514771	2.87
357.4484863	12.34
366.5254517	3.74
367.2972717	10.49
374.7072754	9.63
375.327301	4.03
377.9866028	15.61
385.240509	21.14
389.5250854	4.15
403.25354	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	610.72
Annotation	Unknow
Peak:m/z	Relative Intensity
206.6252747	0.11
274.6716919	0.34
290.8421631	1.54
358.9104614	0.82
371.0280762	0.17
374.7946167	0.27
377.1536865	0.07
390.8526611	0.12
399.1828613	0.24
407.0087891	0.10
412.4675903	0.13
436.9692993	0.17
442.6506958	11.31
443.2659912	0.08
444.7640991	0.35
448.7181396	0.04
456.9122314	0.23
458.6971436	5.78
472.8599854	0.39
474.8059692	0.88
479.1994019	0.05
480.7235107	0.10
503.5914917	1.26
504.6502075	6.66
505.2827759	0.20
520.8989868	0.06
524.5639038	0.05
526.6464844	100.00
527.3774414	0.11
534.6289673	0.08
538.6413574	0.11
542.6401978	1.52
543.2455444	0.24
546.1120605	0.19
546.7299194	0.65
550.7911987	1.35
562.9596558	0.36
564.3313599	3.40
564.9398804	2.92
587.8427124	0.04
592.0630493	0.17
594.2785034	0.21
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
90.90261078	0.30
95.09797668	2.24
97.0663681	0.44
107.0662689	0.72
119.184021	0.21
123.0040665	1.37
125.0259247	1.58
127.0484467	0.46
128.9173279	1.67
132.6591339	0.30
135.0204773	0.28
139.1297913	2.83
140.9389801	0.23
142.9369507	1.41
147.0618896	0.77
149.2704468	1.71
151.2627563	0.30
153.0701599	0.70
162.978241	1.45
167.0318909	0.61
168.969574	3.21
177.1451569	0.31
178.2873688	0.46
181.1537933	2.09
183.3510132	0.23
187.0955658	0.54
191.1920471	0.49
193.0095367	0.39
195.2279053	0.48
197.2336578	0.75
198.144165	0.24
200.1997833	0.45
200.8122711	0.25
207.1247864	1.03
209.5489197	1.01
211.1160889	0.83
212.6029358	0.98
215.2538147	0.41
217.3278503	0.41
219.0571289	1.84
220.9916382	0.98
223.4623718	1.77
224.2264099	0.73
225.1759949	1.48
227.2586975	1.81
229.4838867	0.39
231.396637	0.44
233.0621338	0.93
234.1564636	0.34
235.2113342	1.55
236.9529419	0.32
239.2626648	1.31
247.3672485	0.60
249.2244568	0.19
251.3074341	1.63
252.0625	0.23
253.164917	5.07
257.11026	3.31
262.8707275	0.79
265.4060669	1.99
267.2467041	1.38
268.2922974	0.44
269.1407471	0.30
270.0488586	1.57
275.3266602	13.71
283.2418823	3.51
293.2045898	100.00
294.2271118	2.61
295.5722046	1.04
301.8990784	2.32
305.8950806	0.72
310.4606628	0.25
311.3889465	1.10
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
90.9146805	0.01
114.9126511	4.78
115.9438705	2.26
117.0463028	3.13
131.0270691	0.18
132.0057678	0.20
133.0312805	0.15
159.0132751	100.00
159.9820251	55.59
160.9683838	53.10
199.0863037	0.17
200.0549011	2.28
201.0756836	2.33
202.0925293	0.11
211.9378967	0.02
216.9909363	0.08
217.9861145	0.93
219.1184692	1.07
221.2339783	0.02
228.9192200	1.66
229.9808350	23.07
231.0260315	27.39
244.2334595	0.02
245.3268433	0.10
246.3043518	0.59
247.0620117	0.59
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	361.1503
Annotation	Suspensoside A
Peak:m/z	Relative Intensity
113.0314636	0.14
114.8317947	0.05
124.9354401	0.23
130.9598236	1.05
134.9627075	0.07
139.3642731	0.04
143.0723572	0.40
146.825592	0.04
155.0552826	9.16
161.0709229	0.47
164.8479309	0.16
169.0177612	0.04
179.0133667	0.06
188.9670715	0.13
197.2061462	0.25
199.0875854	100.00
213.0849609	0.14
223.1036987	0.10
231.0120239	0.17
241.1750793	4.07
244.3500977	0.06
245.2523193	0.06
253.300293	0.04
255.2157898	0.05
256.1570435	0.05
257.4118347	0.27
266.2185059	0.08
269.8857727	0.43
271.0939331	9.94
275.368866	0.10
283.2912598	0.14
285.3924255	0.07
289.3289795	0.17
296.9880981	0.09
299.4304199	0.25
301.1364441	18.86
307.1547546	0.27
313.1137695	0.50
315.1901245	5.77
315.9353333	0.05
317.021637	0.03
323.1777039	0.03
325.2822266	0.45
326.3085327	0.19
331.069519	1.17
332.3113403	0.08
343.1509705	14.27
346.4399414	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	601.1384
Annotation	Unknow
Peak:m/z	Relative Intensity
178.9914551	0.94
221.1817932	0.43
229.0310059	0.08
232.9185791	0.28
250.6512604	0.13
259.0823669	2.66
281.1444397	0.38
301.0195923	0.05
321.2408752	0.09
323.3153687	1.17
341.1954956	1.26
355.3825073	0.10
364.3737793	0.12
383.2435303	6.00
395.4625854	0.21
400.1212158	0.05
403.2414551	0.11
412.4855347	0.30
413.2272339	0.15
417.3083496	0.14
421.1987915	2.27
422.3305664	0.19
425.2531738	0.60
428.9229126	0.12
437.1199951	0.14
439.2319336	6.95
442.9784546	0.52
451.4475708	0.11
452.9530029	0.18
453.8543701	0.26
454.9389648	0.24
465.2029419	0.27
467.2018433	0.24
468.1549683	0.38
484.9787598	0.32
486.1630249	0.49
503.3453369	100.00
511.3704224	0.16
539.2344971	0.22
541.3982544	0.27
563.2290649	0.26
564.1779175	0.14
565.1159058	0.12
583.3622437	17.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	476.2782
Annotation	PE(18:2(9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
139.9733887	0.16
153.0874329	0.09
171.0743408	0.04
196.1226807	1.32
214.1507568	1.77
259.3874512	0.05
261.3379822	0.23
279.2831421	100.00
279.9352722	0.12
316.2352905	0.02
415.2360535	0.36
429.7063599	0.02
430.4571228	0.03
441.3094482	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	437.9715
Annotation	Unknow
Peak:m/z	Relative Intensity
151.2047882	0.10
202.3218231	0.03
234.2214355	0.05
239.3409119	0.03
242.2146912	0.02
244.9931335	0.14
258.5013123	0.07
269.8686829	0.06
275.0474548	0.11
300.4404907	0.08
303.2246094	0.04
304.0859680	0.30
315.3289795	0.04
316.1910706	0.03
318.2885132	0.04
329.2462158	0.04
330.1190796	0.08
331.0623169	0.18
332.0605469	0.25
333.2285156	0.05
344.3186340	0.03
347.9697266	0.62
363.3744507	0.04
373.3259583	0.08
375.1672668	0.19
376.1091003	0.10
377.1706848	0.06
383.4173584	0.06
392.1746521	0.15
394.0520935	100.00
402.2347717	0.28
419.2010803	2.26
420.1446838	1.86
428.7736206	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	461.1584
Annotation	Rocagloic acid
Peak:m/z	Relative Intensity
133.2335205	0.03
136.9888306	0.11
147.1927185	0.10
149.1764069	0.14
160.9714661	1.09
163.0869598	0.11
177.1231232	2.27
193.2672119	0.04
199.1389923	1.14
249.1544495	0.06
255.0617981	0.08
259.0756531	0.09
263.2389526	0.14
273.2875061	0.10
275.0850220	0.09
281.3189697	0.05
289.2447815	0.03
290.6018066	0.10
291.2178650	11.76
295.2740479	0.75
299.0294800	0.04
305.4968262	0.21
315.1651001	0.21
323.1509705	10.37
332.9760132	0.08
337.2077637	0.69
339.5455933	0.09
343.5450439	0.04
357.4434204	0.14
361.1294250	0.09
397.3477173	0.15
407.4040222	0.06
411.3821716	0.22
419.2818909	0.09
425.2643127	0.20
429.2619019	100.00
433.1559448	0.09
442.4192200	0.14
443.2677612	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	353.0876
Annotation	Scopolin
Peak:m/z	Relative Intensity
107.1872711	0.02
126.7877960	0.07
133.9626312	0.02
135.1267853	0.97
142.9426880	0.04
161.1163025	0.68
173.1697540	0.69
176.9303894	0.02
179.0228271	4.43
179.6501160	0.06
191.1362305	100.00
196.0643311	0.01
233.2998352	0.28
250.3522949	0.05
262.8420105	0.11
264.9694519	0.05
267.1124573	0.02
291.2849731	0.02
295.3466492	0.02
306.0024719	0.02
309.1259155	0.06
316.2618408	0.01
322.5555725	0.02
323.2796021	0.05
335.3236084	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	225.1635
Annotation	Unknow
Peak:m/z	Relative Intensity
67.0621796	1.28
76.8859558	2.08
79.0438385	5.69
80.9783554	1.39
83.2089081	0.51
91.0003433	6.82
92.9458160	1.77
95.1019287	1.82
96.9612884	0.40
102.8533936	0.78
104.9165497	10.60
106.9817047	1.50
108.9864502	0.88
115.0712738	4.28
117.0103455	10.87
118.9709167	1.17
123.3484650	0.39
125.1202240	0.63
127.1319427	2.13
128.0321045	3.90
129.0280457	21.68
131.0721436	8.27
132.9526978	0.29
135.1353455	1.35
137.1391754	0.51
138.8205414	0.40
141.0035095	51.88
142.0033722	3.54
143.0923157	13.28
144.4083405	1.39
145.1536255	4.11
147.2371063	3.15
152.9760895	26.69
154.0730743	40.00
155.0998077	100.00
155.9685211	0.97
156.9609833	3.66
159.1383820	6.15
160.3247223	0.42
162.5295410	0.34
163.8388214	0.52
165.1004791	1.20
167.1368561	15.97
168.1204376	17.58
169.1175079	50.56
170.0666656	0.76
171.1424713	1.28
179.1986847	0.32
181.1240997	8.40
182.1253967	11.53
183.1251373	34.68
184.0500793	12.06
189.1968384	0.34
189.9970093	0.19
194.0338898	0.50
195.0952301	4.74
196.0869598	5.68
197.2106476	10.14
207.1001740	3.15
208.2968903	0.74
226.1537476	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	410.85
Annotation	Unknow
Peak:m/z	Relative Intensity
122.9190674	0.67
190.8245239	2.60
206.9361877	0.99
217.2431641	0.14
227.1544495	0.26
235.1985474	2.17
236.1278381	0.36
237.3251648	0.24
243.0043640	0.11
258.7969055	24.61
267.0514526	0.23
274.8309021	100.00
275.4391479	0.74
298.4685059	0.28
326.0512695	0.62
326.8652344	5.10
342.3260498	0.87
342.9341125	7.36
365.1875305	0.37
393.5442200	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	447.2234
Annotation	L-Linalool 3-[xylosyl-(1->6)-glucoside]
Peak:m/z	Relative Intensity
128.8689117	0.51
130.8170471	0.23
138.9186707	0.09
142.9667358	1.18
144.7090759	0.07
148.7103424	0.41
158.9463348	1.43
161.0717926	14.49
171.0498657	0.08
173.0395203	0.06
181.1606750	0.08
189.3507385	0.07
191.1546326	0.47
202.8481598	0.13
215.0595703	0.28
233.1802673	1.28
255.3120422	0.07
275.2902832	0.04
293.1422729	1.03
301.1918335	0.22
315.2090759	100.00
357.5721741	0.48
359.1606445	0.19
363.7406616	0.14
373.2843018	0.12
384.2806396	0.07
411.5315247	0.04
427.2251282	0.19
429.1533813	0.47
429.9273071	0.18
432.5198364	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	297.2418
Annotation	18-Hydroxyoctadeca-9Z,12Z-dienoic acid
Peak:m/z	Relative Intensity
94.95066833	0.34
96.99017334	0.28
105.1019745	0.34
107.1234665	0.34
109.2367706	1.21
110.83078	1.96
117.1257553	0.24
122.8008881	3.04
125.1915894	1.38
127.214325	0.41
137.1011353	1.28
139.1016541	2.10
141.0601807	2.91
155.0124664	0.60
169.0477142	2.07
170.9906616	0.66
183.1420135	1.86
189.0383301	0.72
199.1480408	1.48
201.2254944	0.47
203.2784729	0.57
205.3633118	0.37
209.2997437	1.21
211.2135925	1.42
213.2311707	0.34
217.1460266	1.17
219.5130615	2.32
221.2532654	7.91
223.2964783	1.02
225.2127991	1.53
227.1030579	2.86
233.2576599	2.42
237.0210571	5.18
239.1900635	9.11
243.3005371	1.29
251.2556152	0.90
255.3638611	3.84
256.0806885	0.34
261.301178	3.62
265.3553467	0.31
270.2514648	0.37
279.2251587	100.00
280.0899658	1.77
281.4342041	0.66
288.7671509	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	612.64
Annotation	Unknow
Peak:m/z	Relative Intensity
311.7766113	1.57
328.3390503	2.37
498.1685791	6.97
499.1134033	2.59
515.7348633	1.89
539.0620728	6.70
565.9596558	78.96
567.0144653	100.00
568.9846802	0.67
582.8478394	12.44
583.7469482	44.26
584.7325439	14.82
596.7339478	0.95
611.9757080	1.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	175.1185
Annotation	L-Arginine
Peak:m/z	Relative Intensity
59.8663025	28.72
69.9237518	4.36
72.0149383	1.54
77.8197784	0.23
111.9946136	4.83
112.9958038	0.85
113.9784851	4.84
115.9185333	48.31
130.0183868	33.71
131.0630188	1.18
133.1199646	0.41
140.0135345	1.77
140.8712616	0.07
151.0931396	0.35
157.0156250	82.96
158.0845184	100.00
166.1889191	0.38
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	353.0876
Annotation	ST077074
Peak:m/z	Relative Intensity
111.040802	0.01
112.9783325	0.02
126.9557495	0.07
132.951004	0.08
135.0749817	0.85
136.0910034	0.08
144.2385254	0.03
145.1595459	0.01
153.2849121	0.04
155.1134338	0.03
156.1282959	0.01
161.1685486	0.64
171.0769653	0.03
173.0992737	0.63
174.1365662	0.08
179.0379486	6.01
180.1154785	0.82
189.164917	0.01
191.035675	100.00
192.1164246	7.97
204.8816833	0.01
210.1388855	0.02
231.9629211	0.01
233.12677	0.27
234.0570984	0.02
263.1220093	0.04
271.293396	0.03
275.2860413	0.02
298.9961548	0.02
309.2886353	0.14
335.6781006	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	694.3701
Annotation	Unknow
Peak:m/z	Relative Intensity
212.0849457	0.25
219.3075409	0.07
226.2607422	0.50
228.9232330	0.26
231.3218994	0.03
239.2794952	0.12
255.3847809	0.14
280.1997375	0.23
322.4336548	0.11
328.2194824	0.27
337.1836548	0.06
339.5078125	0.18
351.2698975	0.06
361.5464478	0.07
379.3602905	0.98
380.6907349	0.59
382.3037109	0.32
400.6035767	0.09
403.3927002	0.05
404.6063843	0.07
406.4691162	0.25
414.9432373	0.26
415.8492432	0.07
417.4629517	0.05
426.4272461	8.97
427.4368286	3.04
428.4351807	0.20
431.3179932	0.11
433.3113403	0.08
443.7483521	0.34
444.5623779	0.63
445.4657593	0.20
446.2408447	0.12
458.4105835	0.88
459.4272461	1.35
460.2848511	0.12
461.4739380	0.04
471.1552734	0.65
476.5348511	7.78
477.4366455	1.01
478.8198242	0.12
479.9878540	2.44
480.8239746	0.13
483.2722778	0.17
487.4154053	0.08
504.6019287	0.14
512.6648560	0.11
514.5596924	0.14
516.2853394	0.08
526.0800171	0.10
532.4054565	0.24
533.3654175	0.27
536.4983521	0.32
539.4405518	0.06
540.2786255	0.05
543.3715210	0.63
545.1149292	2.36
545.7590942	0.07
555.6450195	0.36
556.6720581	0.27
564.1395874	0.20
566.6593628	0.09
570.4753418	0.12
573.3700562	0.98
574.4908447	0.11
581.1708374	9.34
582.1857300	0.57
586.8034058	0.26
588.4106445	0.99
589.6811523	0.54
590.5365601	0.06
592.0778198	0.63
598.9412231	0.16
599.5820923	0.57
602.1041260	0.35
604.4729004	0.26
606.3892822	5.10
607.5669556	2.02
608.3947144	0.18
612.5820923	0.43
620.8229980	10.29
621.6950684	5.23
622.7448120	0.26
629.7394409	100.00
630.6064453	6.41
632.0607910	0.17
633.5078735	0.20
634.2550659	0.13
635.0903931	0.18
636.4253540	0.19
638.3700562	0.14
648.8950806	0.10
650.8369141	0.24
654.6110229	0.19
655.9718628	0.51
661.6423950	0.06
665.0288696	0.48
667.5971680	0.15
668.4628296	0.08
669.4116211	0.06
672.9664917	0.11
673.6893311	0.09
676.3409424	0.31
677.5402222	0.28
685.7348633	22.32
686.6412354	4.08
687.8064575	0.04
688.4172974	0.05
703.5695190	0.14
707.8230591	0.34
717.4666138	0.41
718.4199829	0.15
720.5245972	0.19
721.9710693	0.07
738.5470581	0.06
739.7368774	0.12
753.5393677	0.21
755.8699951	0.22
764.8395386	0.84
765.6554565	1.59
766.5412598	0.51
779.3788452	0.14
782.6185303	9.82
783.6141968	2.53
784.5895996	0.36
794.0838623	0.08
796.6842651	0.10
797.6604614	0.24
798.4674683	0.08
799.4476929	0.08
800.1403809	0.24
800.8944702	0.06
814.3641357	2.07
815.6943970	1.57
816.8395386	0.20
817.6263428	0.10
821.4135132	0.16
900.6629028	0.06
910.5520020	0.13
926.6040039	0.61
927.5041504	0.49
937.2365112	0.59
944.0411987	0.57
944.6862793	2.26
945.6689453	1.61
946.4302368	0.46
1010.6818240	0.03
1029.4940190	0.17
1144.8349610	0.11
1162.7604980	2.51
1163.7127690	0.59
1167.7778320	0.09
1185.5206300	0.12
1201.6613770	0.28
1225.4582520	0.13
1242.8879390	0.30
1244.1461180	0.21
1244.7952880	0.10
1259.8702390	0.05
1314.9567870	0.23
1315.7490230	0.14
1316.7225340	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	365.1049
Annotation	Lactulose
Peak:m/z	Relative Intensity
168.9595337	0.29
184.9555664	60.41
203.1047058	100.00
205.1585846	0.56
213.0301819	0.44
222.2490234	0.30
231.2555542	1.53
233.4203796	1.02
272.8786926	1.00
275.1342773	1.35
285.3679199	0.65
305.0718079	1.49
330.0902100	1.14
346.1385803	1.43
347.1703491	1.08
348.3389587	0.63
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	587.91
Annotation	Unknow
Peak:m/z	Relative Intensity
175.9608154	0.10
198.9822998	0.30
217.1260223	0.07
245.0780945	0.14
273.1040039	3.12
274.0469971	0.42
357.0498657	0.14
387.1887817	0.54
387.9302979	0.15
389.1417847	0.12
390.1480103	0.09
402.9732056	0.14
415.9450073	0.12
427.0034180	4.05
428.1754761	1.29
429.2637939	0.15
430.1440430	0.09
446.1177979	0.14
455.9070435	0.19
471.1181641	0.21
472.9291382	2.40
474.1105347	2.73
485.1243286	0.25
497.0113525	0.18
497.8261108	0.12
501.9850464	0.23
503.0566406	0.05
513.2907104	0.39
520.1465454	0.39
527.2883911	0.08
529.1563110	0.23
530.9596558	0.11
532.0968018	0.18
538.9711914	0.30
540.9824219	100.00
541.9358521	72.21
543.3212280	0.45
543.9780884	0.50
556.1071167	0.07
559.1024780	0.20
560.0548096	0.38
565.0462646	0.09
569.1200562	0.16
575.4655151	0.06
588.0000000	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	225.06
Annotation	Calcium Gluceptate
Peak:m/z	Relative Intensity
88.7734222	0.22
156.1900787	0.08
168.7186432	0.09
174.2808380	0.23
179.0120850	100.00
205.0588531	0.09
207.1427155	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.11
Annotation	fagopyritol A1
Peak:m/z	Relative Intensity
100.9594879	6.63
106.8818893	4.11
111.0072327	1.16
113.0474091	26.48
118.8804016	28.95
130.0627289	1.89
130.9361877	10.13
143.0655212	27.47
155.1333923	2.09
161.0078735	14.32
167.008728	4.33
179.0622559	100.00
190.9226074	1.07
202.9866943	2.37
209.1340027	2.02
210.3076782	2.16
225.2371826	8.15
248.9218445	2.52
253.0426636	8.64
257.101593	3.03
261.0391846	1.07
269.1491089	1.98
281.3215027	6.17
285.4405518	1.07
286.9669189	0.80
293.6111755	2.34
295.0947876	32.57
297.157074	13.14
304.8134766	6.51
307.2451782	5.44
313.3294983	1.89
326.8929443	5.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	431.1194
Annotation	Griselinoside
Peak:m/z	Relative Intensity
122.6937103	0.32
124.9169769	26.20
128.7512360	0.20
137.0525055	0.30
142.9649048	10.92
151.1656036	1.26
160.4250488	1.52
161.0346832	6.60
163.1723938	0.63
165.1000061	1.45
167.1602173	0.75
176.9052124	0.15
178.9669037	11.11
185.0796814	0.34
191.0066376	2.35
195.0797577	0.27
201.5906677	0.17
203.0764771	29.14
209.3085022	0.59
225.0635071	5.26
238.9775085	0.40
243.0551453	18.83
251.0929565	0.18
269.1824036	3.86
287.0673218	4.55
299.2831421	1.68
301.2236023	0.52
305.2532959	6.39
311.0863037	1.45
329.0126038	100.00
329.6827393	0.62
351.0180054	0.43
367.4646301	0.24
368.4076843	4.54
369.0804749	34.12
369.7583618	0.14
371.1168823	0.94
385.5451355	0.89
386.2298279	0.55
387.2612305	1.56
388.7210388	0.48
401.1830139	0.17
413.1971741	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	349.0545
Annotation	Inosine 2'-phosphate
Peak:m/z	Relative Intensity
115.0778809	0.16
116.8888245	0.26
123.0384674	3.26
134.9420471	0.10
139.0028992	0.97
140.9802246	3.34
142.8822174	0.16
145.0349884	4.79
147.1766663	0.35
161.2461853	0.53
163.0236969	100.00
165.0586548	0.60
167.0688171	0.61
169.0220490	98.06
173.0147247	0.38
175.0317841	0.77
178.9305878	0.65
181.0187378	0.37
185.0059357	0.79
186.7600403	0.22
191.0357056	1.23
193.1221924	0.88
198.0515900	0.34
200.2033386	0.37
205.1490479	1.41
215.0558472	2.03
216.9869995	0.22
219.0354614	1.29
220.9158020	0.68
231.2428284	0.78
238.9131775	1.41
241.2224426	1.60
243.1539001	1.46
245.2143860	0.15
258.2307129	0.26
259.2609863	2.05
261.1655273	0.16
269.1227417	4.62
271.0386658	0.26
275.0710754	0.43
278.1679688	0.46
280.9323120	0.14
285.0648499	21.54
286.4584656	1.52
287.1434937	4.52
289.1512451	0.81
295.0928955	3.39
303.0447998	3.80
305.1831055	2.28
306.0873413	0.18
313.1080017	35.41
320.8778076	1.14
328.5922852	1.03
329.8642578	0.14
331.0391235	11.48
339.4115601	0.65
349.3195496	0.56
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	271.19
Annotation	Celorbicol
Peak:m/z	Relative Intensity
77.12005615	0.69
91.1502533	0.42
97.0005188	0.92
99.00967407	0.42
104.9449768	0.67
110.6908264	1.22
126.9224243	1.39
130.8037567	1.59
135.1884766	1.42
141.1244659	0.25
142.8273468	3.64
147.2064667	0.39
151.1352997	0.66
154.9750519	2.03
156.9447174	2.13
158.2741852	1.25
158.9098663	0.87
161.0138702	0.35
162.8212738	0.35
170.9921417	0.63
173.2857056	1.10
175.2551117	0.77
179.2304077	0.95
183.0188141	0.46
193.0978851	2.06
197.0159454	6.89
203.186676	1.08
206.9325256	2.11
210.9290771	3.72
213.1831818	1.88
215.228363	0.65
224.2796631	2.79
225.1995239	3.09
227.2240601	0.85
230.2462616	1.28
235.2262573	6.29
237.3585052	0.46
238.5587616	3.21
243.118103	2.55
249.9340057	1.63
253.1740112	100.00
254.4020538	0.25
256.2464294	0.95
261.3826294	2.12
262.2446594	1.51
270.6350403	1.59
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	566.2516
Annotation	Unknow
Peak:m/z	Relative Intensity
161.9181824	0.33
168.9572449	0.16
174.2853241	0.27
179.0922241	3.81
196.9501648	0.11
199.1996155	1.61
204.2966614	0.29
216.0903015	0.51
220.8126373	0.49
223.0885620	0.33
226.0872345	0.44
233.3370667	0.12
250.7979126	0.11
253.1714935	0.27
259.1273499	0.17
271.9981689	0.15
274.1533203	15.37
275.3843079	0.27
284.1752319	0.32
287.3094482	0.39
290.3538818	0.18
291.2869873	0.58
293.3873901	0.17
300.5342407	0.21
307.0463257	0.62
308.2661743	3.41
309.1716309	0.26
324.2208252	0.44
334.0751343	0.68
341.5429077	0.64
350.1152344	0.23
353.1261597	1.11
370.3181763	0.25
370.9298706	0.21
378.2974243	1.07
385.2956543	1.02
402.4510498	0.71
404.4459229	1.45
407.5651245	0.30
408.2329102	0.43
419.2834473	100.00
421.1854858	0.17
422.0845947	2.77
427.6256104	0.36
431.4924316	0.71
435.9715576	0.46
437.2522583	23.05
446.5317993	0.50
462.8080444	0.92
473.3659668	1.49
477.5684814	0.20
488.4268799	0.21
491.2608643	5.49
493.5551147	0.80
503.0951538	0.35
507.3884888	0.17
511.1673584	0.66
519.7564697	0.27
548.3034058	6.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	575.143
Annotation	Unknow
Peak:m/z	Relative Intensity
201.2238312	0.07
218.0346680	0.05
267.0538025	0.04
291.8033447	0.02
293.1425476	0.04
311.5947876	0.05
322.2322388	0.02
343.2420654	0.07
347.7409668	0.05
348.3586426	0.03
363.0798950	0.02
381.0524902	0.04
382.4707642	0.05
384.1091309	0.05
387.2944336	0.03
393.3139038	0.03
395.1490479	0.08
429.2817993	0.14
430.3003540	0.10
431.6721191	0.03
442.7994995	0.02
446.7154541	0.02
449.5278320	0.03
457.3107300	2.86
458.3818359	1.00
460.2894897	0.03
461.6726074	0.09
470.3321533	0.02
471.4273071	0.03
475.2563477	0.67
476.3497314	0.90
479.1135864	0.04
480.4728394	0.12
482.9124756	0.07
484.2379150	0.17
485.2194214	0.27
486.1092529	0.28
487.2160645	1.89
488.2014160	0.59
491.7210693	0.10
494.6923828	0.05
498.3517456	0.06
501.2144165	13.43
502.2503662	5.09
503.0974121	0.09
504.6494751	0.08
508.5730591	0.05
511.5957031	0.04
513.3016968	0.21
514.3291016	0.16
517.2433472	0.01
519.2451782	4.38
520.2826538	1.74
521.4017944	0.12
529.2037964	0.83
531.1815796	100.00
532.1881714	31.04
532.9702148	0.21
537.7970581	0.13
547.2955933	0.20
548.0795288	0.34
549.1701050	0.06
550.4731445	0.04
551.3210449	0.09
552.1898804	0.12
557.2804565	0.52
558.3446655	0.28
559.1173706	0.02
563.3929443	0.05
564.9137573	0.03
566.4890747	0.13
568.3860474	0.05
569.0894165	0.02
571.7357788	0.05
576.2710571	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	306.0766
Annotation	Glutathione
Peak:m/z	Relative Intensity
100.9667740	0.05
116.0631638	0.28
120.8063278	0.07
124.8669434	0.08
127.9650803	8.90
135.2550354	0.19
143.1185913	9.81
145.0273132	0.42
146.1553040	0.66
152.8110657	0.38
159.9940796	10.75
166.0946198	0.18
167.1483765	0.80
169.2600555	0.11
170.1981812	0.11
171.1194458	0.50
177.1067200	7.75
179.0658722	9.39
181.1404266	0.05
182.9331360	0.09
184.0097046	0.06
185.0408630	1.05
186.9944000	0.06
197.0036621	1.51
210.1864624	6.20
211.2013550	0.05
212.9904480	1.51
215.1240234	0.10
223.8431702	0.06
228.2650146	0.89
231.0892639	0.73
236.1472778	1.04
237.4016113	0.16
242.2225952	0.60
244.1973267	0.22
252.8147278	0.09
254.1406860	92.57
260.1380615	0.51
262.3768921	0.07
272.1549377	100.00
288.0972290	69.46
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	361.1657
Annotation	(+)-Jurinelloide
Peak:m/z	Relative Intensity
108.0930786	0.13
108.9885025	1.91
111.0287476	0.17
119.1115875	0.26
121.9685822	8.71
123.0758438	1.19
128.9887543	0.80
131.0011597	0.63
135.0256653	0.51
136.0461426	2.36
136.9662781	0.18
142.8580933	0.30
147.0267334	3.38
149.1710358	1.32
150.1532288	0.35
155.0762482	5.35
158.2721558	0.21
159.0872192	0.47
161.1247406	0.72
162.0532684	0.74
163.0671234	0.18
163.9805603	0.21
165.0141907	35.82
166.2550354	0.33
168.8568420	0.18
172.1176147	0.18
173.1716156	0.12
174.2268982	0.14
175.7516785	0.86
177.4311829	0.65
178.1924896	0.49
179.0825043	24.17
180.0884705	0.57
187.1360626	0.09
188.1442261	0.23
190.2070618	0.18
191.0132141	0.45
192.1530762	0.71
193.2647705	1.13
194.1055603	0.13
199.1570435	53.67
204.9929352	2.55
207.2122650	0.15
208.2135620	0.22
209.2639313	0.98
213.1608276	0.16
217.2793579	0.08
219.4262695	0.16
221.1981812	0.10
223.0143127	6.17
227.5097046	0.68
231.1923828	0.43
237.1315613	2.18
239.2639160	0.18
241.2361755	4.86
253.0242920	0.53
254.1033936	0.17
255.4453735	0.21
258.1866455	0.21
268.2326660	0.48
269.1522827	0.60
271.0877075	6.05
274.9560852	0.22
279.1956177	0.23
281.2941895	3.92
281.8972778	0.11
282.8017578	0.50
283.5208130	0.11
285.2404785	1.32
286.0590210	1.06
289.3054199	0.24
296.8811035	0.20
298.2911682	11.18
299.3041992	1.90
300.0501709	0.10
301.0964966	17.38
302.1458740	0.16
303.3895264	0.06
307.3953247	0.23
309.9750977	0.34
311.1503296	0.18
313.2510376	29.29
314.2381897	0.07
315.2431641	8.61
316.2574158	3.44
317.3184204	0.78
319.1872864	1.03
323.1779175	0.35
325.3287964	2.26
328.2560120	1.67
329.6159058	0.50
331.3339233	16.44
341.4952393	1.09
343.2462158	17.43
346.2027283	100.00
346.9884338	0.52
360.9684448	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	203.0826
Annotation	Tryptophan
Peak:m/z	Relative Intensity
68.92533875	1.29
71.92881775	0.36
72.99386597	0.20
73.86313629	0.95
74.92619324	0.05
86.97573853	0.05
96.97018433	0.71
98.95062256	0.16
110.756073	0.07
115.9437866	32.70
117.0386963	0.17
118.2579041	0.04
122.9993439	0.04
127.9404144	0.08
129.0270996	0.07
130.0379333	1.33
131.2681427	0.09
132.1077881	0.57
139.1539154	0.19
141.0752106	1.14
142.0991821	13.66
143.1324615	0.04
157.3093262	0.21
159.090271	100.00
173.0819855	2.26
184.9752655	0.69
186.013382	11.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	207.05
Annotation	Methylglucopyranosiduronic acid
Peak:m/z	Relative Intensity
100.0140839	0.29
101.0000458	0.51
112.9895172	0.41
118.9983826	2.50
135.0668945	1.37
142.9754791	3.05
145.3937073	0.35
148.4694824	0.25
149.9963226	0.38
161.0479126	100.00
163.0519257	57.43
165.2598419	0.78
177.0690765	0.45
179.7676086	1.21
189.0606232	3.02
206.9469452	1.69
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	484.2
Annotation	Unknow
Peak:m/z	Relative Intensity
254.1788635	0.16
322.0441284	0.22
331.4498291	0.98
337.1489868	1.70
345.3446655	0.22
353.8187866	0.32
377.3045959	10.14
391.2686157	0.43
398.2302856	0.36
403.7480164	1.52
420.1982727	1.97
421.1896667	0.35
423.9942627	1.21
429.9125061	1.88
431.9411316	0.39
435.4702454	0.29
440.0881042	0.73
446.3452759	0.24
448.3660889	19.76
449.2594910	3.03
453.5011597	0.85
454.5299377	0.56
465.2732544	3.65
466.3865356	100.00
467.2172546	1.53
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	416.8
Annotation	Unknow
Peak:m/z	Relative Intensity
175.3274536	0.28
212.8834076	0.67
265.0319519	0.30
280.9281616	9.71
319.1197510	0.14
332.9049683	35.01
347.0208740	0.14
348.8618774	100.00
353.4736633	0.27
370.8927307	0.75
372.9298401	0.37
393.4526978	0.32
END