#DEFINITION	Reference Metabolome for Brassica oleracea Botrytis Group
#IDENTTFIER	RefMeta-Brassica oleracea Botrytis Group.R1
#FORMAT	msr
#VERSION	1.0/R1
#KEYWORDS	RefMeta
#ORGANISM	Brassica oleracea Botrytis Group
#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 Brassica oleracea Botrytis Group 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	1222.18
Annotation	Unknow
Peak:m/z	Relative Intensity
345.4681396	0.15
353.1573181	0.22
355.3088684	1.15
366.2141418	0.13
374.7689819	0.78
398.3759766	0.39
400.0219116	0.12
410.0992432	0.57
416.4312744	0.12
418.4744568	0.35
436.2177124	0.30
442.4047852	0.36
453.4311523	0.14
455.3637085	0.22
459.4304810	0.16
465.6383667	0.29
474.5253296	0.15
501.4100342	0.12
502.9051514	2.19
511.9770508	0.22
515.1368408	0.34
518.0909424	0.64
519.2932129	0.30
521.3736572	0.14
525.8425293	0.52
543.3146362	0.56
550.0602417	0.25
554.4613037	0.51
577.5831299	0.73
584.6917114	0.53
586.1826172	1.85
590.5329590	0.20
597.2093506	0.85
612.1835938	0.34
616.1666260	0.54
643.9904785	2.52
653.7103271	0.29
668.6190186	0.25
673.6292725	0.50
676.7403564	0.14
682.4073486	0.13
687.3557129	0.86
689.6889648	0.31
693.4515381	0.37
721.4537354	0.95
726.4806519	1.72
727.4665527	0.45
728.5533447	0.14
731.4384766	0.17
734.2409668	0.57
743.0960083	7.91
744.3673706	4.68
745.5633545	1.89
756.8489990	0.70
759.7460327	0.24
761.3237305	0.34
765.6365356	0.37
767.2970581	0.46
774.5722656	1.09
778.7239380	2.03
788.4492188	0.35
797.0316162	0.70
799.5718384	0.18
811.3089600	0.54
822.2259521	0.25
824.0911865	0.13
825.5013428	0.28
831.2822266	2.38
837.3568115	2.37
838.6145020	0.49
842.8444824	1.35
857.3963623	0.10
859.6428223	0.90
860.3637695	0.13
869.9593506	0.24
874.3647461	0.40
875.9122314	1.06
878.5184326	0.29
882.4602051	1.59
889.2915039	1.16
890.4421387	0.14
891.5708008	1.13
895.8885498	1.18
897.1035156	0.45
900.6175537	0.58
901.7645264	0.64
903.2469482	0.37
907.6372070	1.09
908.4833984	0.28
913.2233887	3.80
914.1402588	3.96
916.9584961	1.80
921.3646240	0.61
923.1361084	0.17
927.5941162	1.20
930.3687744	0.32
932.6562500	0.47
934.6119385	0.64
936.4069824	0.53
946.0837402	1.80
952.2067871	3.41
952.8505859	1.32
954.7694092	0.33
956.2393799	1.33
960.5117188	0.69
969.8048096	0.96
972.6475830	0.71
975.3259277	0.56
977.2366943	1.06
977.9693604	0.85
981.3385010	0.99
984.1412354	1.31
987.7855225	0.46
988.6590576	0.45
989.6616211	20.56
990.4332275	2.97
991.4417725	1.19
992.6019287	0.27
998.4810791	2.01
1009.4953610	0.41
1013.2246090	1.21
1014.0063480	1.13
1014.7886960	3.37
1015.9335940	0.55
1017.7967530	0.28
1022.2170410	1.67
1027.1639400	0.66
1029.4736330	0.43
1032.6594240	2.71
1034.7939450	0.17
1039.7386470	1.11
1045.5324710	0.32
1047.2469480	0.90
1050.1574710	1.04
1053.8248290	0.54
1054.4606930	1.14
1055.5375980	2.72
1056.8818360	0.68
1057.6024170	0.48
1067.0152590	1.13
1068.5703120	0.92
1074.3464360	0.59
1084.2722170	0.84
1087.9694820	0.27
1088.6910400	1.65
1090.2457280	2.82
1090.9704590	0.39
1094.4989010	1.81
1098.4637450	0.37
1100.7429200	2.62
1102.8554690	2.15
1106.1518550	1.36
1111.3906250	2.25
1112.4057620	3.10
1113.4266360	1.19
1115.9311520	1.61
1116.8396000	1.87
1117.6053470	1.20
1122.7005620	7.94
1123.3193360	0.59
1124.3635250	0.35
1128.3176270	2.09
1130.3581540	0.85
1133.2469480	1.41
1135.0545650	1.63
1136.2333980	0.59
1137.2177730	0.43
1138.1967770	3.28
1140.4396970	2.77
1141.5638430	3.64
1142.4133300	2.43
1149.6407470	1.96
1151.9350590	0.79
1153.3931880	1.08
1154.0773930	0.88
1154.7893070	0.19
1156.2950440	2.35
1157.3310550	0.61
1159.6904300	2.18
1160.5864260	0.48
1163.1610110	2.18
1165.3489990	0.96
1166.4477540	10.10
1167.4116210	1.55
1168.9843750	2.28
1171.4925540	6.52
1172.1340330	1.61
1172.7717290	5.23
1173.6066890	0.93
1175.4141850	5.51
1176.4488530	0.43
1178.3178710	42.77
1179.1936040	2.69
1179.8754880	0.43
1180.5050050	0.33
1181.2064210	2.05
1183.8555910	0.64
1185.0163570	1.80
1185.8145750	0.12
1187.1662600	2.66
1187.8375240	0.45
1189.2058110	0.52
1190.3586430	1.36
1191.1546630	0.93
1191.8028560	0.94
1192.6114500	0.54
1194.4920650	0.73
1195.4429930	3.76
1198.2872310	3.37
1199.6296390	0.31
1200.6772460	4.83
1201.8474120	7.58
1203.1445310	33.74
1204.1022950	5.38
1205.6729740	100.00
1206.8999020	8.09
1208.3305660	11.09
1209.6193850	1.44
1210.7250980	0.38
1212.0078120	2.09
1214.0131840	0.18
1215.4897460	1.22
1217.9118650	0.14
1222.0400390	1.77
1223.1700440	0.52
1226.1297610	0.95
1232.5776370	1.12
1234.0163570	1.97
1234.7039790	0.95
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	976.85
Annotation	Unknow
Peak:m/z	Relative Intensity
286.3049622	0.22
294.0257263	0.33
300.0861816	0.13
303.7042542	0.12
310.4786987	0.05
320.0855408	0.11
340.2436218	0.15
347.1120911	0.15
397.4557495	0.15
425.3397827	0.15
426.1805420	0.14
600.2449951	0.09
614.4080200	0.24
619.2822876	0.21
649.5639648	0.33
650.7662964	0.30
659.5737915	0.13
684.5296021	0.13
691.0565796	0.30
703.3442383	0.05
711.5234985	0.32
720.0772095	0.27
727.4749146	0.20
736.0036011	0.10
769.3749390	0.24
772.1499023	0.39
787.6730957	0.07
846.1890259	0.39
848.9358521	0.31
864.5491333	0.10
894.5058594	0.07
897.2278442	0.07
898.5963135	0.17
900.4349365	0.30
911.5748901	0.59
912.6253662	0.26
924.2893066	2.01
926.4094849	0.14
929.3056030	0.13
931.1150513	0.85
932.2814331	0.08
934.8232422	0.15
937.4284668	3.62
939.7739868	0.91
940.8271484	0.30
942.1244507	3.11
944.8001099	9.56
945.4880371	0.63
946.3334351	0.07
948.1160278	0.08
949.0397949	2.25
949.6841431	0.12
951.0939331	1.77
953.6276855	9.20
954.2358398	0.11
955.1838379	0.95
955.9832153	15.75
956.6143188	5.09
957.4600220	0.28
958.2031250	1.13
959.1093750	3.40
960.2555542	0.18
962.0158081	0.13
962.9214478	1.94
963.6001587	0.58
964.4255371	1.29
965.2121582	0.43
966.0971680	0.17
966.7829590	0.97
968.3474731	0.44
970.2414551	0.36
974.1836548	0.17
977.8106079	0.03
1001.0661620	0.59
1020.3313600	0.39
1021.3073120	0.22
1023.1460570	0.16
1025.6882320	0.09
1034.3962400	0.41
1037.1646730	0.62
1039.8734130	1.11
1041.8880620	3.21
1043.1279300	0.56
1045.0600590	1.57
1045.7548830	0.37
1047.4058840	1.11
1048.7802730	0.32
1051.8410640	0.71
1054.5771480	0.29
1055.6102290	0.32
1056.3983150	1.24
1057.8670650	1.25
1060.0649410	2.35
1060.6838380	1.04
1061.3287350	0.19
1062.8615720	5.89
1063.4708250	1.72
1066.1328120	11.17
1067.1166990	0.83
1068.4084470	1.18
1069.8868410	1.94
1070.8739010	0.35
1071.8287350	0.10
1076.1617430	0.09
1077.4810790	7.91
1078.1785890	2.58
1078.9993900	3.50
1080.0272220	3.64
1080.6921390	0.10
1081.5996090	5.08
1082.2595210	0.87
1083.7840580	2.61
1084.6547850	3.08
1085.8352050	0.14
1087.0892330	6.50
1087.7380370	6.65
1088.8852540	2.97
1090.0593260	7.39
1091.0390620	2.11
1091.7254640	1.39
1092.9434810	4.55
1094.0812990	5.46
1094.7216800	0.64
1095.8937990	3.69
1096.9549560	1.61
1098.2875980	4.81
1099.1242680	5.33
1099.8730470	0.18
1100.9903560	7.26
1101.9846190	14.24
1102.6225590	1.15
1103.3442380	0.35
1104.3146970	9.65
1105.1557620	3.12
1106.4228520	7.46
1107.2080080	0.18
1107.8189700	2.26
1109.1083980	7.11
1109.8665770	6.21
1110.6138920	1.13
1112.4410400	31.02
1113.2006840	0.88
1113.8627930	0.22
1115.2978520	100.00
1116.4216310	1.81
1117.3394780	2.64
1118.1445310	13.55
1119.9421390	2.11
1121.1907960	6.28
1122.8455810	2.23
1125.4989010	2.24
1127.9667970	1.24
1130.8835450	0.63
1132.2775880	1.14
1133.7050780	11.54
1135.0871580	1.15
1136.6386720	10.71
1137.2409670	4.00
1139.1079100	0.10
1141.4750980	0.45
1145.5042720	0.13
1148.4967040	0.78
1152.7109380	0.35
1169.6629640	0.98
1170.8806150	0.05
1171.6661380	0.07
1179.8829350	0.78
1180.7073970	0.46
1182.0876460	0.25
1187.3363040	0.32
1188.4367680	1.19
1189.7943120	0.76
1191.2359620	0.83
1192.0544430	1.28
1195.1616210	1.19
1196.1892090	0.86
1199.2866210	0.38
1202.7563480	2.92
1203.4392090	0.24
1204.4796140	0.46
1208.0906980	1.09
1209.7596440	2.85
1211.4334720	1.00
1213.1185300	0.34
1214.3424070	1.40
1218.9890140	1.57
1220.7258300	0.74
1222.0828860	0.31
1224.0617680	1.57
1225.3842770	0.95
1226.0476070	0.49
1227.4948730	0.86
1228.9602050	1.45
1229.9069820	1.01
1231.2314450	1.01
1231.8852540	1.74
1233.1629640	0.73
1234.8483890	0.59
1236.4541020	4.28
1238.6132810	0.13
1239.4445800	0.46
1240.1428220	0.77
1242.4857180	1.11
1243.5065920	1.53
1246.1975100	3.55
1247.2188720	0.18
1248.2431640	0.97
1249.8404540	3.82
1250.8205570	2.08
1251.5338130	0.35
1253.1057130	0.74
1253.8190920	0.39
1255.6235350	1.27
1256.4357910	1.38
1257.0561520	0.67
1257.6567380	0.65
1259.8466800	2.20
1260.4542240	0.04
1261.3947750	2.07
1262.3757320	2.41
1263.2724610	0.04
1263.9422610	0.53
1265.8564450	3.23
1266.9006350	0.79
1268.4614260	3.11
1269.1782230	2.87
1270.0041500	1.44
1271.4110110	1.19
1274.1767580	2.27
1275.0261230	0.35
1275.8238530	0.62
1277.3531490	0.74
1277.9818120	1.36
1279.2285160	2.13
1279.9505620	0.92
1281.2247310	2.03
1282.4974370	1.70
1283.2586670	1.23
1285.0552980	1.85
1286.0662840	0.72
1287.2254640	1.12
1287.8636470	1.05
1288.6179200	0.21
1289.6226810	1.32
1290.9481200	2.15
1292.0350340	1.41
1292.9167480	1.37
1294.0020750	0.43
1295.0855710	1.42
1295.8848880	0.78
1296.8939210	1.67
1297.8088380	3.07
1298.6693120	0.81
1300.3620610	1.14
1301.2208250	0.33
1302.1810300	1.38
1303.9315190	3.09
1306.5648190	0.71
1307.2789310	0.17
1308.8045650	0.62
1310.3801270	0.77
1311.6127930	2.44
1312.6959230	3.85
1313.5091550	0.71
1314.8858640	1.52
1315.6682130	0.99
1317.4139400	1.81
1318.2650150	3.01
1319.3084720	0.63
1320.3851320	1.20
1321.3328860	2.41
1323.0682370	0.61
1323.9436040	0.08
1325.0364990	2.04
1329.6063230	0.63
1337.9151610	0.23
1343.4147950	0.39
1346.8078610	0.49
1349.3951420	0.86
1355.3531490	0.45
1363.4508060	1.06
1367.0682370	0.31
1371.7374270	0.23
1372.4221190	0.27
1378.4739990	0.70
1386.1977540	0.36
1389.0343020	0.36
1391.1221920	0.74
1401.4705810	0.07
1404.4132080	0.54
1415.1182860	0.10
1419.1728520	0.37
1419.9468990	0.65
1420.5775150	0.39
1426.1842040	0.64
1429.2108150	0.16
1431.2128910	1.14
1434.1033940	0.07
1435.0490720	0.24
1447.5626220	0.53
1451.3898930	0.45
1454.7061770	0.50
1464.6763920	0.48
1469.1827390	0.09
1470.1739500	0.32
1471.7893070	0.41
1483.6958010	0.85
1488.2397460	0.68
1489.9707030	1.18
1493.7974850	0.34
1498.5474850	0.12
1500.1300050	0.13
1502.4222410	0.29
1506.3922120	0.34
1513.0181880	0.28
1515.2728270	0.44
1517.7249760	0.53
1521.7816160	0.18
1522.4638670	0.66
1526.6052250	0.94
1532.9862060	0.39
1538.1967770	0.30
1539.4538570	0.77
1568.0628660	0.85
1568.7061770	0.37
1571.8145750	0.52
1576.5473630	0.78
1577.4097900	1.13
1581.4843750	0.58
1585.1793210	0.60
1586.4791260	0.12
1590.4964600	0.34
1596.6915280	0.66
1611.1018070	0.61
1613.7088620	1.45
1632.0593260	0.16
1644.1506350	0.43
1644.9202880	0.10
1645.8026120	0.26
1650.9510500	0.09
1656.7546390	0.19
1659.7020260	0.06
1684.4102780	0.14
1710.1315920	0.16
1713.9224850	0.20
1749.0052490	0.11
1763.8742680	0.53
1788.8604740	0.07
1816.5372310	0.06
1830.8060300	0.24
1842.0651860	0.09
1859.9598390	0.15
1866.2213130	0.15
1867.0896000	0.06
1872.3236080	1.21
1899.8244630	0.06
1908.6282960	0.30
1910.8044430	0.05
1922.5882570	0.08
1938.6358640	0.06
1943.3250730	0.25
1944.4260250	4.28
1946.2977290	2.18
1957.4090580	0.09
1963.2355960	0.09
1967.2999270	0.09
1986.0606690	0.18
1988.7042240	5.46
1992.7141110	1.53
1996.6141360	1.33
1997.8396000	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	753.2243
Annotation	Sibiricose A4
Peak:m/z	Relative Intensity
212.8140106	0.03
214.9377441	0.18
217.0986633	0.18
221.3635406	0.06
223.0919952	3.48
230.0310974	0.26
231.1517944	0.11
232.1760864	0.29
233.1104279	0.05
237.2279510	0.02
245.1377563	0.20
246.0076599	0.12
247.0151978	2.41
247.6960449	0.03
248.7908173	0.04
259.1754761	0.28
261.1968994	0.58
262.3752136	0.03
263.1636353	0.11
265.1439819	0.48
272.1656494	0.02
273.2205811	0.03
274.1695557	0.35
275.2854614	0.03
277.1431274	0.57
281.3134155	0.02
286.9995728	0.17
289.1789551	5.13
295.1486816	0.19
303.1793518	0.09
305.2357788	0.07
307.1552734	0.15
313.2681580	0.06
316.1047363	0.09
323.1937256	0.04
331.1592407	1.19
339.3300781	0.05
341.3635864	0.02
349.1495972	0.03
353.1801453	0.02
367.2920532	0.20
381.1693726	0.02
385.2402344	0.27
413.3866577	0.05
423.1389771	0.02
427.2588501	1.09
429.2382202	0.02
453.3221436	0.01
455.4468384	0.02
457.2370605	0.49
465.4240112	0.04
467.0957031	0.05
468.1172485	0.04
469.1583862	0.07
473.2970581	0.11
480.1478882	0.02
483.4274292	0.01
487.1999512	0.79
493.1088257	0.10
499.0429077	0.04
511.2936401	0.62
515.2409058	0.93
529.2023926	100.00
529.8698730	0.08
547.0212402	0.22
567.2322388	0.02
587.3284912	0.05
592.8036499	0.03
611.4748535	0.07
622.8970947	0.05
638.4745483	0.03
648.4833984	0.10
668.3267212	0.07
673.5271606	0.07
674.3356323	0.04
679.6570435	0.04
690.2009277	0.02
693.3111572	0.29
706.9276733	0.05
708.3082275	0.09
709.4212036	0.05
716.3803711	0.03
717.1014404	0.03
734.4532471	0.06
735.0935059	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	363.1537
Annotation	Unknow
Peak:m/z	Relative Intensity
119.1739807	0.13
123.1568451	0.23
125.0284882	0.12
131.9560852	0.18
135.9572296	4.13
137.0413513	1.82
146.9219208	0.40
164.9226532	6.47
180.5917664	0.27
181.9797363	100.00
182.8867188	0.12
187.9827271	0.07
189.1455688	0.60
215.1164246	0.33
229.3178406	0.47
230.1766357	0.10
231.0717773	0.17
232.1639709	0.31
243.1094055	0.40
245.3236389	0.31
250.4121399	0.19
254.2393494	0.13
272.9325867	1.44
275.0677795	0.17
286.6440430	0.16
287.9585571	0.14
289.1725464	0.33
298.2669067	3.46
299.3973389	3.02
300.0436096	0.17
301.4016418	0.33
302.0262756	0.34
303.2702637	0.25
315.3044434	0.64
316.1607666	5.80
317.1156311	3.53
318.7015381	0.24
321.8327942	0.40
328.1088867	0.09
330.8066406	0.11
345.1741333	1.64
346.0851440	0.50
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	551.1826
Annotation	C20912
Peak:m/z	Relative Intensity
158.8905029	0.20
205.0426941	0.10
209.0366516	100.00
209.9174347	0.28
254.1972809	0.15
274.8711548	0.34
303.3169556	0.87
306.4066772	0.64
321.2562256	0.60
327.1101685	0.10
340.8383789	1.09
341.8105469	0.11
348.1569214	0.14
371.1561890	0.13
385.0750122	0.21
399.9186401	0.44
414.3184204	0.19
422.1651001	0.11
426.9484253	0.11
446.3301392	0.24
453.1466675	0.57
461.2858887	0.33
479.0136108	0.28
487.9949341	0.16
504.1633911	0.13
515.0316772	0.44
531.0598755	0.14
532.0813599	0.72
533.2726440	0.34
533.9497681	0.43
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	241.9992
Annotation	Unknow
Peak:m/z	Relative Intensity
158.6163177	0.81
182.9846039	7.54
196.0638123	3.77
200.8728943	11.88
214.1536407	1.90
218.7993774	1.48
221.1531372	1.13
223.8825836	100.00
232.0634918	0.15
241.8134766	8.94
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	197.0819
Annotation	1,2-Dihydroxymint lactone
Peak:m/z	Relative Intensity
92.7459106	0.03
101.1419678	0.04
102.9279327	0.09
109.1174622	0.48
110.9549103	0.28
122.9334259	0.03
125.0349731	0.02
134.9506378	0.14
139.1157990	0.05
150.9583893	0.11
153.0032501	100.00
154.6982269	0.08
161.0130157	0.05
165.9374695	0.03
166.9150543	0.02
168.2632294	0.04
179.0708771	3.95
182.0233917	1.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	315.0719
Annotation	4-(beta-D-glucosyloxy)-3-hydroxy-benzoic acid
Peak:m/z	Relative Intensity
92.9101257	0.58
94.9758072	0.23
100.9035568	0.44
107.8955231	7.08
108.9918671	6.51
112.9162292	0.52
118.9265900	0.17
120.9338608	2.13
122.8085403	1.54
124.9707794	0.06
128.9024048	0.06
131.3259888	0.05
133.0972290	0.80
134.9835815	1.44
135.9156342	0.47
137.0967102	0.09
144.9721375	0.09
151.0826874	6.29
151.9668579	37.02
152.9406738	100.00
154.1135254	0.23
159.0849609	0.22
160.9671936	0.23
162.9598999	10.56
165.0549011	14.11
166.8664246	0.12
175.1120758	0.21
177.0658264	1.38
177.9927216	0.12
179.0513916	2.53
181.0236511	2.07
183.0862579	0.05
189.0535278	0.52
191.0621490	0.20
193.0757294	1.58
195.0675049	3.92
204.9703064	0.50
206.9765320	4.21
209.0964355	0.05
214.8784485	0.04
217.0653687	0.36
219.1212158	1.63
220.9584351	0.08
225.1309509	7.40
235.0830688	0.20
237.1541138	0.78
239.0736389	0.04
240.3610535	0.10
249.0945435	0.05
255.1952515	0.13
267.1134338	0.13
271.0478516	0.10
283.3428345	0.06
284.1446838	0.07
297.2049866	0.98
304.0062866	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	535.04
Annotation	UDP-D-Xylose
Peak:m/z	Relative Intensity
193.1622009	0.07
211.0873108	1.87
220.3265991	0.12
233.0299225	0.06
252.1943970	0.03
262.3644409	0.02
273.2392883	0.11
280.1362305	1.19
291.0820312	0.47
305.1643982	0.25
323.0531006	100.00
325.6230469	0.02
361.1009521	0.02
362.1212769	0.55
364.8052368	0.02
372.9953613	0.08
378.2557373	0.08
379.2587280	0.11
380.1781006	0.12
385.1611328	1.48
390.2245483	0.06
396.8704834	0.27
398.9050293	0.70
399.9680176	0.13
403.1846924	2.04
415.0936890	0.15
419.3693237	0.03
426.0654297	0.27
437.1714478	0.41
446.9219360	0.05
448.6627197	0.05
450.7839966	14.49
452.0673828	0.04
463.2644043	0.04
464.9793701	0.03
466.8693237	0.29
488.9899902	0.10
492.1806030	0.06
517.2377319	1.23
517.9861450	0.06
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
91.10910034	0.28
93.19615173	0.26
96.88336182	0.52
105.2176895	0.50
109.2400436	0.60
110.9716187	0.64
121.0755386	0.37
122.7754974	0.40
124.8790665	1.08
136.8886719	0.24
138.8905334	1.13
143.1043091	0.72
145.6016235	0.54
149.3294678	0.26
150.8190155	0.26
153.1741638	0.28
154.8067932	0.66
157.0626221	0.37
163.0997009	0.90
169.0766907	0.83
175.2971802	0.33
177.1726379	1.68
179.0540619	0.36
181.0461426	4.33
181.7579346	0.30
183.1098022	1.56
184.302597	0.71
191.2269287	1.02
193.1635284	0.87
195.2628326	0.51
197.0811005	1.26
201.2370453	0.82
203.3256531	0.72
205.0447083	0.65
207.2236023	0.85
209.0764771	1.48
211.2572632	2.02
213.0990295	3.49
214.8679199	0.30
217.3639832	0.64
221.1929321	2.03
223.2213135	1.48
225.2167969	2.93
226.2695007	0.74
227.1636047	1.46
229.0213013	0.38
233.2319641	0.54
235.2225647	5.59
237.0467224	0.26
238.138855	0.28
239.2435303	1.21
241.1618958	2.04
247.11026	0.74
249.1583862	0.18
250.6668701	1.74
251.3320007	1.90
253.0996704	6.42
257.1416016	0.76
261.0890808	0.32
261.8945618	0.85
263.271698	1.82
265.1104736	1.35
266.0342102	0.46
267.2556458	3.46
269.2198181	1.14
270.1130371	0.66
275.2429199	18.29
279.2539978	0.20
283.3123169	1.90
284.2518616	1.00
293.2093506	100.00
294.2409668	1.36
297.6282959	0.34
301.2037354	1.77
302.3081055	0.46
306.8684082	0.49
309.2652283	0.81
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	379.08
Annotation	Didymocalyxin C
Peak:m/z	Relative Intensity
112.8707199	0.03
118.9174728	0.04
131.0323029	0.04
161.0515137	0.33
163.1143799	0.03
179.0631104	0.69
180.0287018	0.16
196.9401550	0.28
198.0711212	0.19
199.1305237	0.93
215.0730591	2.26
215.9877167	1.22
217.0045471	7.32
281.0792847	0.03
341.1447144	100.00
342.1597290	31.30
343.1458130	10.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	365.0875
Annotation	Furocoumarinic acid glucoside
Peak:m/z	Relative Intensity
129.0456543	0.76
130.9140625	0.05
141.1777344	0.06
143.1083069	0.30
145.0149841	0.07
155.1693115	0.15
157.0150146	5.67
158.1692963	3.54
159.1074524	11.40
167.2899170	0.10
169.1548767	0.15
171.0393677	14.28
172.0839844	0.63
173.0114441	4.45
174.1617432	0.03
182.9958191	1.54
184.3521576	0.83
185.0199890	3.01
186.0677948	0.61
187.0695648	0.54
193.4119720	0.18
195.0986328	3.10
197.0434875	0.09
199.1367493	0.61
201.0068665	38.07
202.0143890	100.00
203.1211853	28.00
210.0681763	0.09
210.9770813	0.19
213.0511475	38.97
215.0888062	3.40
217.2073975	0.16
219.2510681	0.06
223.1567078	0.11
225.1758423	1.27
227.0387878	9.56
228.1544800	0.08
229.2057495	0.72
231.0054932	19.57
239.2284546	0.74
240.3065796	0.07
241.0536194	0.50
243.1680298	4.54
245.0372009	25.22
255.0284119	0.99
257.1295166	1.84
267.1603394	1.61
269.0725708	4.75
270.9951782	0.19
273.1565247	0.07
275.0796204	49.01
285.1020203	0.31
287.1627808	1.34
288.8307495	0.08
292.7731018	0.05
299.3037720	0.25
302.8302917	0.21
305.1200562	0.21
307.1848755	0.11
310.9353333	0.11
319.0639038	0.13
321.1425781	0.16
329.2463989	0.49
344.6231384	0.13
346.0471802	0.09
347.0462341	1.90
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	643.1724
Annotation	Oxidized glutathione
Peak:m/z	Relative Intensity
210.0699463	0.03
215.2604370	0.07
216.9336395	0.56
258.9832153	0.05
287.9689941	0.03
303.1125183	9.19
305.2885132	0.10
321.1415405	5.66
337.2330933	0.13
339.4583740	0.10
341.0653076	0.08
342.0376587	0.02
346.2610474	0.06
358.2603149	0.07
363.3451538	0.21
375.9841919	0.11
381.2147827	0.32
393.9715576	0.04
416.3762207	0.20
419.1942139	0.70
422.3906860	0.17
424.5442505	0.14
432.9892578	0.10
437.1072998	1.33
466.9724121	0.36
476.9967651	0.09
479.1907959	21.16
484.2690430	0.08
485.3451538	0.12
495.1763306	0.12
497.2393188	9.91
506.6901245	0.19
509.1682739	0.13
528.4800415	0.03
539.2500610	30.57
539.8539429	0.12
544.2498779	0.07
596.8940430	0.11
599.5468750	0.08
625.1725464	100.00
625.8364258	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	700.64
Annotation	Unknow
Peak:m/z	Relative Intensity
330.8538208	0.48
362.4606323	0.64
368.7698975	0.36
370.8302002	2.10
386.5699463	0.30
448.5154419	0.94
455.6966553	1.04
486.7142334	0.65
488.9011841	1.66
524.5236206	0.24
526.8405151	0.79
532.5708008	2.74
544.8279419	4.27
547.5175171	0.71
548.6761475	0.46
550.8687744	0.35
570.4513550	3.72
580.7011108	0.28
582.7605591	1.81
601.9544067	2.77
614.1061401	0.95
616.4635620	20.11
623.7325439	1.21
632.1427612	0.36
654.5779419	100.00
658.1380005	3.37
658.8571167	0.53
664.7772217	0.24
677.1016235	4.38
677.8433838	0.74
682.7401733	8.14
691.6378784	0.95
700.6272583	7.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	306.1365
Annotation	Ala Asp Thr
Peak:m/z	Relative Intensity
105.1420746	0.10
115.1439972	0.03
121.9812469	10.58
129.9449005	1.24
131.1054077	0.15
136.8651428	0.05
149.146347	0.35
150.8516541	0.28
155.5537415	0.06
160.1648254	0.18
167.0835571	4.17
167.9856873	0.13
174.8367157	0.50
177.2230072	0.03
184.9805145	13.81
185.5874786	0.05
191.0594788	0.08
193.2195892	0.08
206.0882568	0.07
207.6722717	0.11
209.9344788	0.18
217.0348816	2.28
222.2262573	0.21
225.2859192	0.04
229.221283	0.08
233.3890076	0.13
235.2536621	0.15
239.2327576	0.11
242.2671204	0.86
243.0628662	0.55
244.9079285	0.13
246.0374146	0.20
249.009491	0.18
252.0159302	0.10
256.8872375	0.49
259.493042	0.25
260.2388306	0.32
261.2198181	0.04
261.9984131	0.03
265.1094971	0.10
269.5533447	0.41
270.2166748	11.40
273.4022217	0.10
275.2160034	0.18
275.9015198	0.21
277.9472046	0.22
278.9085083	0.09
288.1191101	100.00
289.1635132	1.72
292.2971802	0.24
297.7139587	0.13
305.144043	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	392.1476
Annotation	2-(Glutathion-S-yl)-2-methylbut-3-en-1-ol
Peak:m/z	Relative Intensity
115.8226624	0.12
117.0012817	0.09
129.9162292	0.10
145.0547485	0.04
148.8921814	0.58
149.9007874	0.17
151.0770569	0.14
158.0799255	0.03
159.9796753	0.23
161.1048889	0.15
161.9696350	0.29
167.2146454	0.19
179.0160522	0.80
198.0618439	0.10
227.8897705	0.23
229.1587219	0.05
245.0876465	100.00
246.0346069	0.55
260.2967529	0.08
263.0920105	26.62
271.0116882	0.26
272.0421753	0.18
278.9261475	0.15
279.9508667	0.28
299.1310425	1.42
308.0321350	0.65
315.3997803	0.07
317.1574097	7.00
329.4719849	0.16
331.5126953	0.08
356.4339905	0.07
371.9539795	0.03
374.1372681	5.04
375.2604980	0.19
375.8760681	0.05
382.5221863	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	505.9868
Annotation	2-hydroxy-dATP
Peak:m/z	Relative Intensity
162.8121643	0.08
211.0878754	0.05
216.8551941	0.04
222.9491882	0.03
231.0804749	0.04
247.0839691	0.06
249.0453033	0.08
266.1853333	0.05
282.1522827	0.28
288.0158997	0.04
297.9513245	6.42
299.3390198	0.04
327.8986816	0.13
329.2645569	0.11
329.9092102	0.11
333.3762512	0.12
356.9154053	0.04
376.1755676	0.10
377.0065918	0.08
402.1798401	0.31
405.1697083	0.13
414.3330383	0.09
422.0757751	100.00
422.6953430	0.24
426.1863098	0.23
437.9817200	0.08
458.1764526	0.05
459.8285217	3.87
470.3735046	0.34
476.1239624	0.07
487.0617371	0.07
488.1334534	0.43
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	426.2876
Annotation	Prostaglandin E2 serinol amide
Peak:m/z	Relative Intensity
131.1491394	1.68
132.85289	2.15
135.1593475	1.70
137.1114655	1.83
144.980835	12.91
150.0294647	6.38
153.1118164	3.81
161.3158569	2.31
165.165329	2.40
197.1517029	5.43
199.1017456	6.92
202.9366302	5.82
208.9854126	3.42
210.8816223	5.25
216.1524811	2.63
219.8227692	1.83
228.1993713	2.87
231.1368713	5.89
241.8843689	4.29
245.4399719	5.12
253.3308411	2.65
265.3585815	6.41
279.0791626	1.66
281.5249023	1.99
284.7581787	2.31
286.5308838	11.70
297.602417	1.83
305.4956055	15.14
319.3051758	2.30
326.2143555	4.45
328.7261353	6.10
332.1833801	11.39
334.1633911	5.72
336.2649231	6.53
337.3202515	7.25
338.2652893	12.52
339.372467	23.49
340.318512	4.67
349.4302979	1.53
352.1466064	2.94
356.8129883	3.42
369.9779358	15.27
377.2771301	10.10
380.5146484	10.38
381.1386108	4.45
383.1696472	4.00
383.8223877	5.18
384.8029785	10.04
385.4045105	1.67
389.6635437	19.33
390.7614136	12.82
395.0280151	13.90
398.3054504	25.78
407.2026062	8.47
408.2635193	100.00
426.6490784	4.18
427.3615112	7.36
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	611.1442
Annotation	Glutathione, oxidized
Peak:m/z	Relative Intensity
177.0696106	0.34
178.5122681	0.39
179.1261749	1.55
180.1203766	0.29
182.1448822	0.22
184.9871063	0.39
186.1581421	0.06
192.1800842	0.43
193.2798157	0.10
196.9437256	0.39
202.9878693	0.07
210.0467072	2.86
211.0938873	0.08
214.17099	0.11
226.10466	0.27
228.1217346	0.04
235.9964294	0.16
239.9784546	0.06
242.200943	0.09
243.1748352	0.07
252.2231445	0.07
254.1547546	14.38
255.1610107	1.11
263.0366516	0.11
270.0748901	0.04
272.0933838	33.40
273.1396484	3.06
286.2313232	0.97
287.1253052	0.29
288.1936646	4.83
289.2271118	0.70
296.239624	0.05
304.0750732	14.86
306.0693359	100.00
307.1901245	9.38
310.1459351	0.06
319.9633179	0.19
320.9743042	0.06
338.0504761	40.43
339.1043701	3.55
353.0772705	0.42
362.1635132	0.04
464.1582642	2.08
465.213501	0.20
482.1856689	34.55
483.2263184	5.23
490.4936523	0.35
536.1867065	0.08
575.2184448	0.93
576.1033325	0.29
593.161438	18.32
594.2040405	3.58
594.9009399	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1061.8424
Annotation	Unknow
Peak:m/z	Relative Intensity
292.5433960	0.69
343.9538879	0.20
357.0177002	0.31
363.1897583	0.73
375.3532410	0.51
377.9110718	0.51
391.2824097	0.34
409.3840637	0.28
420.5840149	0.31
424.2619934	0.23
427.2522278	0.31
442.0053406	0.30
445.3810425	0.16
450.3164673	0.15
455.2793579	0.33
473.4297180	0.21
490.5142212	1.11
497.5487671	0.57
508.9215393	0.15
524.4399414	0.36
562.3311768	0.50
569.5585938	0.18
572.2752686	0.82
579.6801758	0.16
580.4364624	0.39
593.4591064	0.28
601.5646362	0.21
605.2167969	0.43
616.0442505	1.16
620.5538330	0.82
623.2543945	0.22
624.3016968	0.87
630.3464966	1.83
656.6384277	0.56
657.7901611	0.27
658.6276855	0.52
669.4846191	0.22
671.6923218	0.65
680.5666504	0.85
683.6272583	0.53
688.4721069	0.37
690.0708008	0.30
690.7857666	0.67
691.4881592	0.61
695.7283325	0.92
697.2380981	0.89
698.4565430	0.40
701.6154175	1.80
707.6099243	0.13
708.3519287	0.58
712.1823730	0.78
715.4136353	0.59
717.4614258	0.55
719.1734619	1.23
733.4887695	0.71
741.9755249	0.31
750.0711060	1.23
752.8051758	1.26
755.7611084	0.48
759.3444214	0.38
760.1124268	0.67
767.5495605	0.36
769.4032593	2.26
773.6210938	0.40
776.7037354	0.52
778.0236206	0.68
781.4213867	2.10
786.4750977	0.33
794.4283447	0.16
802.6381836	0.29
803.4299316	1.33
816.6678467	2.40
818.3421631	0.64
819.2657471	0.32
819.9342041	1.36
821.6798096	0.91
824.9758301	8.33
825.8009033	6.75
827.6497803	0.61
837.3729248	0.54
845.3948975	0.56
850.0191650	0.51
854.2645264	0.41
856.6116943	0.95
858.0260010	0.96
864.6038818	1.11
865.6372070	1.02
866.4256592	0.80
872.1094971	0.77
874.7589111	5.16
875.8934326	0.73
881.6147461	0.77
885.0546875	0.95
907.6724854	0.16
908.6364746	0.61
913.7205811	0.24
914.3590088	0.13
916.7558594	1.29
921.5806885	3.14
923.0185547	1.52
929.8085938	0.48
930.6574707	2.05
931.5281982	1.29
935.3857422	0.20
936.3510742	0.36
938.0656738	0.35
939.1954346	2.38
957.7574463	0.68
968.0693359	1.00
969.9750977	1.67
971.8391113	1.73
975.7583008	1.64
976.3612061	1.18
981.1990967	0.81
982.2944336	0.95
985.3438721	1.85
993.6958008	2.65
994.4511719	2.73
995.0770264	1.22
995.7170410	0.49
1001.2385250	0.68
1003.3875730	2.38
1005.2447510	1.54
1009.3586430	0.63
1015.2692870	0.30
1018.4283450	0.75
1023.2209470	0.32
1024.7205810	0.29
1029.5920410	0.37
1030.9121090	0.65
1033.7263180	0.15
1036.1706540	0.90
1040.6262210	1.07
1042.3544920	1.56
1047.8720700	3.54
1048.5377200	1.82
1050.1997070	4.31
1051.8349610	0.51
1052.5695800	0.33
1066.7625730	0.51
1078.1193850	0.37
1087.7579350	0.33
1089.7624510	0.80
1096.1842040	1.30
1111.8249510	0.32
1122.7109380	0.82
1123.6903080	0.56
1124.3109130	0.47
1127.0610350	1.19
1134.4132080	0.38
1136.2480470	2.64
1136.9284670	5.60
1137.8309330	1.48
1140.9140620	1.10
1143.1514890	0.97
1144.6177980	0.27
1145.8999020	0.18
1146.9323730	0.24
1147.9348140	0.16
1148.7468260	0.47
1151.9016110	0.61
1159.4672850	0.52
1160.8120120	0.41
1161.9018550	1.05
1162.8666990	0.22
1176.7125240	1.08
1177.7009280	1.16
1179.0253910	0.72
1179.7912600	2.43
1180.8114010	1.42
1186.4521480	3.03
1187.3590090	0.46
1193.7211910	0.37
1204.3710940	0.78
1215.8637700	0.92
1223.8040770	0.56
1224.7241210	0.58
1232.7058110	0.35
1235.5852050	0.59
1259.5975340	1.00
1260.9384770	0.58
1263.0609130	0.62
1275.9787600	0.45
1277.8471680	0.75
1280.4127200	0.12
1283.2940670	0.20
1284.3403320	2.59
1288.9527590	0.34
1292.2634280	0.13
1292.9899900	3.96
1293.9102780	2.25
1300.8304440	0.38
1306.9747310	0.31
1318.5195310	0.77
1320.9581300	0.32
1324.5310060	5.81
1325.8210450	4.49
1327.3511960	1.14
1328.0101320	0.09
1334.7623290	0.57
1339.2926030	0.28
1347.8920900	2.34
1358.5773930	0.27
1362.9254150	0.25
1377.8924560	0.88
1388.7415770	0.25
1398.0825200	0.18
1398.7178960	0.66
1406.9757080	1.52
1408.7796630	0.33
1419.5557860	0.36
1420.7423100	0.62
1423.7032470	2.20
1424.9165040	1.49
1426.0072020	0.16
1436.7830810	1.94
1437.8897710	1.61
1438.9157710	0.15
1458.8714600	0.87
1471.3568120	1.51
1475.6729740	0.95
1487.5155030	0.21
1496.3446040	0.65
1497.3277590	3.91
1501.9194340	0.66
1505.5665280	4.03
1506.5250240	7.13
1508.3302000	0.45
1516.1077880	0.22
1517.3160400	0.85
1518.3941650	0.22
1519.0886230	0.48
1536.0775150	5.79
1536.8444820	5.21
1537.7747800	1.88
1551.5216060	0.25
1555.7464600	0.58
1562.9591060	0.44
1604.8792720	0.58
1632.1055910	0.34
1633.0843510	0.61
1649.0750730	5.64
1649.8889160	3.54
1651.0363770	1.76
1651.6812740	0.10
1652.4578860	0.83
1694.3044430	0.44
1721.1203610	0.51
1731.0769040	1.28
1737.6929930	0.20
1739.6022950	0.49
1746.1258540	0.57
1747.4110110	0.61
1748.0216060	0.49
1749.2790530	0.40
1761.0821530	0.53
1775.3538820	0.83
1799.6862790	0.75
1803.8312990	0.21
1807.1027830	19.16
1819.3988040	12.90
1820.3739010	0.21
1830.2331540	0.39
1839.4854740	0.22
1843.1551510	0.74
1853.9479980	16.12
1860.1456300	0.78
1864.0291750	2.00
1865.4930420	0.15
1867.9849850	0.48
1871.2781980	1.04
1878.9027100	0.16
1887.4532470	0.25
1888.2252200	0.74
1889.5762940	0.18
1890.4451900	0.16
1899.7188720	0.69
1901.9909670	0.40
1904.3625490	1.07
1905.2015380	1.81
1908.6060790	0.18
1911.4361570	0.36
1917.6929930	0.70
1922.2282710	0.33
1927.0855710	14.07
1930.1219480	0.13
1932.2398680	0.19
1935.2023930	7.07
1937.5697020	0.24
1941.2584230	0.34
1942.4484860	4.53
1944.4422610	1.04
1945.7570800	0.28
1946.4866940	0.87
1947.3331300	0.54
1947.9803470	0.30
1953.8050540	4.11
1955.2362060	99.07
1955.8677980	0.21
1957.6336670	0.49
1959.8382570	0.78
1961.6568600	4.81
1962.2679440	0.13
1965.6180420	0.58
1969.4871830	0.16
1971.1949460	0.25
1975.5880130	0.39
1976.5233150	0.47
1979.2966310	1.85
1980.8089600	0.27
1981.9534910	5.63
1983.9006350	0.33
1985.0662840	3.51
1987.6329350	16.28
1988.6055910	2.51
1989.6906740	3.63
1991.9367680	2.52
1994.9464110	100.00
1996.0992430	1.61
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	406.1
Annotation	Tintamine
Peak:m/z	Relative Intensity
218.1921387	0.69
232.0252380	6.33
251.1213379	100.00
321.9512939	4.42
337.8632202	0.81
346.4579468	0.48
360.2521057	0.60
388.1374207	1.46
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
159.0021057	3.90
160.0335541	0.76
161.0736237	1.02
179.0145569	0.07
199.1156006	0.48
200.0140381	0.30
201.0364227	0.36
217.2407074	0.05
218.9510803	0.16
228.9623413	0.81
230.0729980	0.17
231.0157928	0.34
273.0346069	52.83
274.0376282	32.18
274.9850159	27.27
312.8380737	0.04
387.0168762	53.97
387.9690247	100.00
389.0387878	82.71
429.1449280	0.06
430.0927429	0.01
456.3047791	0.06
457.0492249	0.14
459.0032043	0.04
472.0067444	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	606.0733
Annotation	UDP-D-galactose(2-)
Peak:m/z	Relative Intensity
175.0294495	0.37
176.9229584	0.50
199.1727600	0.04
211.0964203	1.33
212.3143768	0.13
218.8890991	0.08
222.0618896	0.69
240.2133484	0.28
241.1118469	0.19
243.1173553	0.28
246.1110535	0.66
255.0666046	0.31
261.0319824	1.45
262.0981445	0.04
264.0644531	1.05
272.9863892	13.71
280.1608276	0.38
282.1123657	32.79
287.3008423	0.06
291.0528564	0.50
300.1742554	4.52
302.2256165	0.13
305.1306763	5.75
313.0092773	0.03
323.1931458	23.70
324.1417236	1.14
325.0740967	1.73
326.1318970	0.26
330.1926880	0.05
331.0667725	0.57
333.1672974	4.06
334.2257690	0.87
335.1917725	0.09
341.9620972	0.11
344.0194702	2.02
352.0303955	0.11
360.1630859	0.20
362.0556641	23.30
364.1358643	0.10
365.1878052	0.03
367.3291626	0.06
378.2549438	0.12
378.8817139	0.22
380.2484741	0.13
381.5494995	0.22
385.1487427	100.00
392.0539551	0.18
400.2402954	0.09
403.0570068	60.60
404.3495483	0.07
410.9461670	0.07
413.9960938	0.04
427.1455688	0.03
428.9244995	0.08
430.9332275	2.36
431.9906616	0.22
432.7276001	0.05
441.2301025	0.06
442.0166626	0.13
443.0582275	1.76
444.1127930	0.32
448.9375610	0.08
450.8916016	6.67
464.0398560	0.10
465.4285278	0.11
466.6392822	0.58
467.6191406	0.08
468.8952026	2.83
469.8449097	1.01
470.8229980	6.17
472.0535278	0.34
473.0328369	0.12
483.0707397	0.38
485.1599121	1.75
486.2050171	0.22
487.1218262	0.04
491.3122559	0.04
493.0713501	0.40
494.2213745	1.28
506.6138306	0.20
508.2315063	7.01
509.2120972	0.06
520.0006714	0.04
520.9039917	0.93
521.9530640	0.62
522.5764771	0.16
526.2011108	0.40
559.0861816	0.26
562.0379028	4.28
563.1860962	2.19
564.0260010	0.07
575.6889038	0.10
582.7102661	0.28
587.1076660	2.14
588.0405273	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	527.2834
Annotation	Unknow
Peak:m/z	Relative Intensity
167.1040649	0.06
168.1678314	0.35
175.1782227	0.03
180.0036621	0.06
186.0864563	2.27
207.2561340	0.70
208.3227997	0.03
224.8864441	0.03
226.1212311	0.32
228.2574768	0.05
242.0952148	0.10
244.1890259	0.22
245.0575714	0.06
254.2769623	0.09
257.1914673	0.06
268.1624146	0.21
281.0897522	0.15
282.0289001	0.15
299.2574158	0.60
300.2705688	0.03
301.0474854	0.04
305.4384766	0.03
313.2882690	0.13
320.9376221	0.05
325.1444702	0.05
326.0833130	0.10
327.2068481	0.06
328.7148438	0.11
329.3369141	0.05
335.4131470	0.18
351.2647705	0.15
357.4615479	0.13
363.1353760	0.03
365.3095703	0.20
366.2015991	0.11
367.4828491	0.10
370.3227539	1.47
382.9678955	0.10
387.2655640	0.11
388.4241943	0.09
389.1716309	0.11
390.6045532	0.04
394.2661743	2.74
395.1574097	0.48
408.8210449	0.12
410.2521362	0.09
412.3281860	100.00
413.2995605	0.22
414.6096802	0.03
416.3109131	0.26
426.2737427	0.18
431.0331421	0.10
437.1518555	0.06
441.3584595	0.07
443.1621094	0.12
446.3372192	0.12
447.4483643	0.05
452.9460449	0.04
455.4525757	0.04
462.6152954	0.07
464.3854980	0.11
465.2778931	0.26
467.3188477	0.10
481.3018188	0.18
483.3847046	1.91
485.4061279	0.21
491.3597412	0.52
496.2037354	0.06
497.5626831	0.08
499.0872192	0.06
508.5878296	2.02
509.2875366	15.81
510.1581421	0.10
517.3300171	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	374.1071
Annotation	DIMBOA-Glc
Peak:m/z	Relative Intensity
118.7907181	0.52
123.0479126	0.51
128.0299072	0.26
136.0579834	2.56
147.1274414	0.60
148.0157013	0.12
164.9104919	9.44
165.5685730	0.17
182.0446777	100.00
186.9919891	0.13
199.3337402	0.23
212.1509552	0.04
240.0346680	0.13
243.1282043	0.67
245.3472595	0.14
258.2190552	0.06
261.3648376	0.12
262.0885620	0.08
276.9236450	0.15
283.9237366	0.24
299.3417969	0.14
310.2360535	6.06
311.2520142	0.26
312.3564758	0.15
316.8716736	0.15
322.2866211	0.67
328.0628052	0.44
329.0677795	0.42
337.9098511	0.08
341.9941406	0.69
345.8919678	0.28
355.1560364	0.25
355.9287415	1.25
364.1999207	0.95
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	357.2492
Annotation	Lys Pro Ile
Peak:m/z	Relative Intensity
123.9047394	1.02
126.0478058	0.22
128.9670563	1.08
130.0856934	0.24
132.2798767	0.13
138.0602112	0.13
142.0004272	4.46
146.9248657	0.25
151.9067078	3.85
155.0096741	0.15
164.0115967	0.07
169.3965149	1.06
170.0489197	2.09
172.1559753	0.19
175.3655396	0.16
179.1906586	0.07
186.2229767	0.26
197.0920715	0.78
201.3751526	0.21
207.1891479	0.40
208.6988678	0.40
209.3508759	0.08
215.1397095	1.34
224.0585327	0.16
225.033905	0.41
226.2210999	1.24
229.1592102	100.00
229.9468079	0.13
234.2627258	0.07
236.2174377	0.24
240.1640015	0.31
242.1421509	1.65
243.12146	0.64
252.1854858	0.27
254.2896423	0.09
258.2200317	10.35
262.2962952	0.06
268.2398987	0.78
269.1051636	0.40
270.0129395	1.17
272.2027588	0.69
280.29422	2.72
281.2080078	0.09
293.2070312	0.06
294.1050415	0.59
296.1420898	0.07
298.2117004	27.95
301.6834717	0.06
312.3608093	0.12
318.8356323	0.17
339.1957703	5.23
340.1663208	2.35
366.4488831	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	271.07
Annotation	S-(Hydroxyphenylacetothiohydroximoyl)-L-cysteine
Peak:m/z	Relative Intensity
109.2149048	0.10
121.1613464	0.08
122.0538788	0.15
133.8471222	0.99
146.9721527	0.09
150.0199127	11.19
152.0351410	26.46
155.1347504	0.12
163.0571136	0.88
166.1114197	0.59
167.1662750	0.07
168.0186310	0.11
175.0933380	3.37
176.1195984	6.63
178.4821320	0.17
180.9582825	0.19
182.1658020	0.05
184.0321960	2.71
188.1178894	0.05
191.0558929	0.37
192.1110229	0.77
193.0589905	0.58
194.1310425	0.06
197.2617645	0.20
206.9827423	0.56
209.1110382	3.84
210.0957794	0.45
219.0995636	11.38
220.2809906	0.50
225.1032257	2.84
227.1128693	100.00
229.7307892	0.77
231.0674286	0.06
234.9763947	0.85
237.0389862	35.65
237.6724091	0.12
238.2971954	0.17
241.7014771	0.37
253.1068573	4.30
254.1994171	0.68
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	532.71
Annotation	Unknow
Peak:m/z	Relative Intensity
280.7587280	0.15
297.0292358	1.56
338.9498291	0.61
346.1279907	0.13
354.8165894	0.65
356.2269287	0.20
356.8504639	0.50
358.1360474	0.25
358.9809570	0.44
364.8362427	7.98
366.6192017	0.19
369.0226440	0.33
374.8859863	0.21
377.1339722	0.70
380.7508545	17.87
386.8006592	0.29
394.8100586	0.14
396.2282715	0.49
446.7430420	0.53
448.7402954	100.00
463.8923950	0.76
464.8649292	1.59
485.6582642	0.54
487.2200317	0.82
505.1904297	0.16
508.7837524	0.36
509.8639526	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	191.0561
Annotation	Sedoheptulose
Peak:m/z	Relative Intensity
57.0050659	0.28
58.8759346	1.79
60.9166717	0.26
66.9782715	0.48
68.9335022	0.32
70.8037415	6.15
73.0537262	0.29
80.9285736	0.47
82.9960327	4.76
84.9479065	86.56
86.9656067	17.13
92.9601746	55.37
97.2131805	0.28
98.9815369	3.18
108.9746246	20.44
110.9677734	50.71
112.9098511	1.39
115.0186005	1.75
127.0052032	100.00
129.0501251	1.63
137.0105743	1.09
143.0376740	3.66
144.8572998	3.59
147.0073090	0.76
152.9758759	5.05
154.9651184	9.55
171.0455017	35.97
172.9116364	93.35
191.0411530	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	442.8
Annotation	Unknow
Peak:m/z	Relative Intensity
190.8570251	1.87
206.8806152	8.69
245.8999939	0.33
274.8760681	12.67
278.8190308	0.35
290.7984314	100.00
296.7725830	0.56
358.8258667	52.48
374.2206116	0.85
375.2095032	0.55
395.8976135	1.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	791.3151
Annotation	Bn-NCC-2
Peak:m/z	Relative Intensity
231.7660980	0.09
245.1232910	0.05
266.4022827	0.06
280.3755798	0.04
335.4202271	0.17
376.2238159	0.09
385.2329712	0.08
389.0559082	0.10
444.0307617	0.03
464.9749146	0.11
468.5410767	0.10
496.3496094	0.09
498.2769775	0.05
528.6781616	0.06
549.0180054	0.10
567.8003540	0.17
569.2297363	0.21
583.3779907	0.16
585.8686523	0.10
605.3938599	0.09
613.2531128	0.09
621.3516235	0.05
625.8015747	0.06
629.6340942	0.22
673.0422974	0.04
677.1000366	0.04
705.3224487	0.17
707.3395386	0.06
718.5200806	0.03
720.8872070	0.16
729.4486084	0.06
745.1401978	0.04
745.9824219	0.23
747.4317017	100.00
749.7769775	0.03
753.1916504	1.21
755.2291870	0.47
759.4865723	0.09
764.9260254	0.15
768.9553833	0.12
772.6641235	0.47
773.5466919	1.82
782.6424561	0.08
791.0414429	0.05
791.9721680	0.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	422.11
Annotation	Gluconasturtiin
Peak:m/z	Relative Intensity
127.9522705	0.08
138.8176117	0.14
143.1100769	0.37
145.1287079	0.33
145.9607849	0.05
148.8941956	0.04
162.9452209	0.13
165.1045227	0.13
169.9313965	0.04
178.9325256	0.22
180.1135864	1.01
185.0862427	0.03
194.4132080	0.12
195.0191956	0.72
196.2594147	0.05
199.7986145	0.04
206.4532166	0.06
209.1192169	0.22
209.9465027	0.09
211.0997314	0.05
212.9720764	0.05
216.2676697	0.10
226.0645447	0.74
227.2136230	0.57
228.9421082	0.18
230.9563599	0.23
241.1703796	0.22
244.1369934	1.66
248.0802307	0.06
254.1651917	2.13
258.9908142	9.82
260.2101135	0.06
262.8008728	0.14
266.4158936	0.04
272.2048645	26.60
275.0367126	3.47
277.2166138	5.30
278.2088318	2.10
283.2831421	0.04
285.7787476	0.11
290.9237671	0.14
292.9863586	0.05
295.2137451	0.10
301.2276306	0.11
302.5551758	0.12
304.1631165	7.08
305.9588928	0.67
311.4778748	0.04
319.3042603	0.32
320.0120239	1.71
330.9031067	0.05
338.1262817	100.00
342.2159729	1.58
346.3537598	0.04
347.6692810	0.05
350.3662109	0.08
358.1937256	0.05
359.2247925	0.05
360.0869751	0.08
362.3133850	0.05
375.1241760	0.32
376.3363953	0.72
378.4725037	0.40
379.2406311	0.17
380.6828003	0.19
381.9080505	0.08
386.3249817	0.19
390.1534424	0.04
404.1618042	1.88
405.7100830	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	306.0966
Annotation	Melicarpine
Peak:m/z	Relative Intensity
127.4381256	0.04
128.3388672	0.03
129.9776001	100.00
130.8983459	0.17
134.2462769	0.07
163.0955200	0.04
168.7914124	0.02
175.0366058	0.07
185.0054016	0.15
186.8834229	0.09
202.9091187	0.03
203.8884888	0.06
209.8708191	0.02
216.9423218	0.05
219.0864868	0.20
249.2655029	0.04
257.5252075	0.09
258.2367249	0.03
260.2446594	0.13
263.9918518	0.08
269.9863892	0.04
278.1529846	0.07
288.1661072	0.94
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	474.2624
Annotation	LysoPE(0:0/18:3(9Z,12Z,15Z))
Peak:m/z	Relative Intensity
140.0331726	0.01
145.1578369	0.02
152.9828491	0.20
184.1635437	0.02
185.0383759	0.06
188.9641113	0.01
196.2517548	0.04
205.1571045	0.05
214.0822296	1.51
231.2424011	0.02
232.3115845	0.05
233.3427124	0.37
236.7285919	0.03
243.2504425	0.04
246.9909668	0.02
250.3861084	0.05
255.2131653	0.02
259.3117065	0.18
268.2200012	0.02
275.3050842	0.30
277.2636108	100.00
301.4556274	0.05
303.3400269	0.02
308.8494263	0.03
315.2676392	0.06
323.0370483	0.01
333.0993652	0.04
338.3409119	0.02
340.0372925	0.12
343.2833862	0.07
350.4667969	0.02
369.8088989	0.03
374.2554016	0.02
378.4919739	0.07
382.0056458	0.02
386.6407471	0.01
389.5726624	0.03
390.2033386	0.03
391.1923523	0.01
402.3629456	0.04
403.1034241	0.04
406.4348755	0.01
408.2237854	0.04
411.6815491	0.04
414.2278137	0.06
416.4779358	0.02
428.2844543	0.10
430.3694763	0.05
431.2221069	0.09
435.6464844	0.06
438.0829163	0.22
445.2707214	0.03
445.8732605	0.10
447.4644165	0.01
455.0611877	0.10
456.4404602	0.17
457.2207031	0.05
459.3586731	0.02
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
145.0593262	0.05
147.3793945	0.06
196.8542175	1.08
212.7714539	100.00
218.2750549	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	904.54
Annotation	Unknow
Peak:m/z	Relative Intensity
263.3580627	0.07
276.4452209	0.40
316.1252441	0.25
348.3796997	0.18
429.2636719	0.14
437.4943848	0.14
439.1732178	0.07
462.8117676	0.11
516.2672119	0.06
531.8483887	0.08
547.0582275	0.15
556.6861572	0.07
570.2244873	0.35
575.5166626	0.19
603.2991333	0.15
606.4339600	0.10
636.6885376	0.49
640.5736694	0.26
681.5888672	0.20
713.8361206	0.14
720.0842285	0.10
725.4788208	0.13
734.2935181	0.14
740.5273438	0.28
742.3331909	0.25
744.2390747	0.09
765.4904175	0.38
767.5727539	0.13
799.0448608	0.58
804.1138916	0.21
806.3106079	0.08
821.8822632	0.60
822.7075806	0.10
841.2892456	0.08
848.8652344	0.34
854.9915161	0.31
858.7058716	0.33
860.8940430	0.24
864.5177612	1.06
866.9957886	1.62
870.9747925	0.27
873.9669800	0.24
875.5031128	0.14
876.7477417	0.07
877.7975464	0.16
879.7348633	0.73
880.9851685	7.72
883.2710571	1.15
883.8934937	0.14
885.9277954	1.90
886.5382690	0.58
888.8082886	0.14
890.9630737	1.31
892.2034302	0.38
894.4638062	2.06
900.0359497	0.36
942.0820923	0.09
943.6267700	0.08
949.3700562	1.03
950.5313110	0.57
959.6291504	1.04
964.6483765	0.37
970.4653931	0.13
976.6242065	0.47
980.8464966	0.71
982.0475464	0.08
987.1584473	0.66
989.7734375	0.51
992.7609253	0.66
997.2224731	4.40
997.9598999	1.06
999.2476196	5.64
999.9462891	0.49
1000.5874630	0.20
1001.5386350	1.03
1003.1687620	0.58
1004.1030880	3.10
1004.7764280	1.38
1005.8034670	1.41
1008.2780150	3.24
1009.5410770	0.87
1011.2284550	7.69
1011.8399050	3.23
1012.7449340	2.33
1014.0935670	0.66
1014.8920290	0.44
1015.9914550	33.30
1017.0397950	5.22
1017.7683720	0.82
1018.5562130	5.40
1019.7217410	1.18
1020.3283690	0.75
1021.3698120	0.64
1022.2164920	0.35
1022.9548950	0.70
1024.2419430	5.35
1025.1127930	1.42
1026.0019530	4.13
1026.7634280	0.94
1027.4510500	38.49
1028.4646000	1.08
1029.6596680	2.63
1030.5744630	100.00
1031.8791500	5.19
1033.1584470	8.56
1033.9211430	4.07
1035.3515620	2.94
1036.1929930	1.20
1037.0565190	0.27
1037.9375000	0.98
1038.6940920	1.76
1039.4394530	0.61
1040.3011470	0.39
1041.3562010	0.27
1042.1698000	0.23
1042.9063720	0.21
1045.6131590	0.34
1048.6374510	1.30
1053.4841310	1.21
1054.7670900	0.97
1064.3513180	0.23
1072.6401370	0.17
1075.2331540	0.52
1080.0321040	0.74
1086.3024900	0.57
1089.6412350	1.18
1095.0833740	0.45
1098.9382320	0.11
1104.7639160	0.41
1105.5100100	0.71
1110.5363770	1.07
1111.9356690	0.99
1116.8198240	0.13
1118.1739500	0.65
1118.9993900	0.45
1123.1745610	0.80
1125.4285890	0.06
1127.6193850	0.21
1130.0885010	0.70
1137.3288570	0.98
1139.1396480	0.12
1139.9624020	0.26
1141.6871340	0.11
1143.5385740	0.72
1145.8897710	2.35
1153.6160890	0.12
1157.3330080	0.74
1158.2292480	2.06
1160.0725100	0.97
1160.7210690	0.59
1161.8488770	0.88
1163.2543950	3.10
1164.1052250	0.75
1165.2362060	0.57
1168.1662600	2.49
1170.0205080	0.95
1171.3464360	0.51
1171.9887700	1.09
1172.8627930	0.99
1173.8806150	0.48
1175.4163820	2.24
1177.4934080	0.66
1179.6055910	0.14
1181.1878660	1.66
1182.4991460	1.29
1183.2617190	0.37
1185.1640620	0.36
1185.9097900	1.14
1186.8278810	0.99
1189.0816650	1.32
1190.9272460	3.78
1192.3077390	1.70
1193.2358400	2.33
1195.5239260	1.74
1196.5820310	2.81
1197.4666750	0.27
1198.9013670	2.08
1199.6706540	1.90
1200.4812010	0.07
1201.4252930	0.08
1202.9160160	0.96
1203.8891600	1.50
1204.7490230	0.74
1206.0996090	0.95
1207.1866460	2.35
1208.2803960	1.08
1209.6887210	0.95
1210.5954590	2.27
1211.6296390	0.74
1213.4466550	3.86
1214.0587160	5.40
1214.9179690	0.53
1216.5400390	4.35
1217.3455810	0.05
1218.5540770	1.09
1222.7777100	0.07
1225.7694090	0.43
1230.3427730	0.19
1236.8491210	0.18
1241.3039550	0.04
1247.9382320	0.31
1253.6396480	0.18
1272.2255860	0.66
1280.1334230	0.26
1287.5438230	0.09
1290.0838620	0.11
1292.2763670	0.43
1293.7401120	0.24
1314.5555420	0.28
1315.6784670	0.55
1317.5191650	0.65
1321.0161130	0.34
1324.6262210	0.75
1335.4031980	0.34
1339.5327150	0.95
1347.2261960	0.64
1352.1229250	0.29
1353.9844970	0.57
1355.1510010	0.16
1370.6577150	0.17
1372.3310550	0.54
1378.5540770	0.14
1386.0793460	0.14
1388.0151370	0.70
1389.3341060	0.19
1401.4449460	0.89
1410.2148440	0.94
1412.3577880	0.61
1430.2440190	0.28
1436.0974120	1.13
1443.3355710	0.28
1448.7076420	0.24
1452.1649170	0.57
1453.7620850	0.58
1459.9766850	0.35
1460.6687010	0.18
1464.0174560	0.84
1464.8195800	1.98
1467.2780760	0.55
1468.5643310	0.54
1469.2852780	0.79
1471.3580320	0.23
1474.4919430	1.01
1476.0731200	2.40
1481.6108400	0.87
1484.0584720	1.11
1490.6981200	1.23
1493.0672610	0.44
1499.9791260	0.25
1503.1293950	0.80
1507.5819090	0.39
1553.4483640	0.18
1565.3579100	0.33
1567.9631350	0.23
1570.0899660	0.89
1586.7349850	0.15
1598.1580810	0.47
1621.4963380	0.16
1632.8848880	0.09
1634.5393070	0.17
1636.4901120	0.22
1640.5075680	0.15
1646.8712160	0.33
1684.8924560	0.16
1717.2860110	0.20
1725.5021970	0.14
1729.5194090	0.44
1735.8270260	0.60
1738.5007320	0.18
1740.1853030	0.14
1770.3841550	0.36
1777.9616700	0.08
1782.6760250	0.41
1783.5516360	0.07
1788.8024900	1.32
1789.7528080	0.15
1797.1187740	0.74
1799.5784910	0.12
1807.8302000	0.79
1814.1199950	0.14
1853.5026860	0.34
1858.0616460	0.55
1869.2146000	0.21
1891.4324950	0.15
1898.1096190	0.50
1898.8986820	0.10
1906.8909910	0.12
1910.9053960	0.30
1918.6041260	2.87
1920.4045410	0.34
1924.3513180	0.63
1926.0880130	0.20
1930.3502200	0.17
1941.3687740	0.05
1945.9249270	0.08
1950.9260250	5.66
1956.5982670	8.34
1960.4095460	0.54
1965.7629390	1.92
1974.3416750	12.26
1978.6687010	0.15
1981.4455570	0.06
1995.1740720	0.08
1995.8459470	51.72
1996.7969970	1.77
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	609.1198
Annotation	Unknow
Peak:m/z	Relative Intensity
192.7822876	0.02
205.1427612	0.02
207.2652283	0.04
211.1735535	0.17
259.1370239	0.03
261.9899597	0.35
262.8890076	0.07
264.7482300	0.05
267.1278076	0.56
273.3039246	0.03
283.3480835	0.02
307.2548828	0.01
323.1984863	0.11
324.2299194	0.02
325.3489990	0.02
336.1007080	0.11
338.7897339	0.01
341.1197510	0.03
342.1095581	0.02
346.1101685	100.00
346.9357300	0.01
353.9446411	0.02
359.2988892	0.01
376.2807617	0.02
377.1088257	0.02
385.1401367	0.07
387.0859985	0.20
398.1372070	0.11
400.1961670	0.07
403.2198486	0.03
404.0701904	0.03
413.2738647	0.02
418.0887451	0.02
425.3294067	0.07
426.3175659	0.10
428.9906616	0.07
432.0000610	0.04
435.9478760	0.05
443.9404297	0.03
451.2011108	0.03
461.9559937	0.01
470.4062500	0.02
471.2064209	0.02
472.2069702	0.03
473.0108643	0.31
473.6398926	0.21
474.3291626	0.02
478.4077148	0.07
488.1141968	0.07
489.1159668	0.04
493.0394287	0.02
501.2545776	0.03
504.6635742	0.02
508.1293945	0.04
511.1898804	0.07
518.1419067	0.06
519.1508179	0.02
548.1145020	0.43
549.2047119	0.06
562.2451782	0.01
565.7174683	0.04
576.3131104	0.14
589.2604370	0.02
591.0429688	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	218.1033
Annotation	Pantothenic acid
Peak:m/z	Relative Intensity
71.0117798	0.73
87.9062576	100.00
146.0847473	12.02
174.1552124	0.08
200.1225281	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	650.9851
Annotation	Unknow
Peak:m/z	Relative Intensity
190.9575653	0.66
236.0776367	0.08
305.9418335	0.49
311.2880859	0.04
335.8921509	0.11
340.1502075	0.09
342.1835327	0.09
344.0886230	0.83
346.3560181	0.07
355.0797119	0.17
359.9113159	0.05
375.8607178	0.12
388.5246582	0.06
397.3429565	0.33
413.9183960	0.10
416.1024170	0.11
421.1288452	0.06
423.2994385	0.22
441.0027466	0.36
451.3383789	0.09
458.9710693	100.00
459.6020508	0.27
461.1798706	0.11
472.4899292	0.05
473.9525757	0.25
474.8582764	0.24
476.7652588	0.19
489.0652466	0.08
494.2863770	0.07
502.0812378	0.10
507.2351074	0.11
510.3698120	0.23
516.2175903	0.07
517.3295898	0.22
521.2061157	0.07
535.5121460	0.05
536.5403442	0.06
538.2862549	0.04
539.1287231	0.09
544.1946411	0.06
552.6701660	0.45
553.4778442	0.25
587.9255981	0.11
591.5404663	0.08
599.1863403	0.13
608.4746704	0.11
614.1702271	0.07
632.0944214	0.63
633.2709351	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	333.0591
Annotation	alpha-D-Galactosyl-(1,1')-sn-glycerol 3-phosphate
Peak:m/z	Relative Intensity
96.7778015	0.44
139.0129242	0.08
150.9837952	0.51
152.9334717	100.00
154.0882874	0.29
155.0434265	0.04
171.0427094	2.70
176.2689056	0.13
223.0429077	0.54
235.0489807	0.03
241.0045776	91.91
243.1944275	0.06
249.0666199	0.14
259.0355835	1.48
273.1721191	0.43
297.0065308	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	423.9532
Annotation	Unknow
Peak:m/z	Relative Intensity
196.7515869	0.48
198.9245300	0.23
203.6561127	0.21
299.3146973	0.08
309.5241089	0.64
310.9891357	0.95
312.0170288	0.75
312.9920654	4.04
318.2163086	0.19
319.8013306	0.10
327.8985596	0.17
330.7626343	0.50
337.7517700	0.20
339.3096619	0.14
357.1440735	0.26
380.1288757	0.95
384.8688660	100.00
395.7543945	0.14
401.7875977	3.80
402.6609802	21.16
425.5777283	0.54
436.2797241	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	460.77
Annotation	Unknow
Peak:m/z	Relative Intensity
206.8863983	1.92
207.9661255	1.40
208.9232483	7.17
212.7442932	0.73
247.9087830	1.72
249.0372620	0.88
251.0700378	1.33
290.7571106	35.02
291.9055481	7.57
292.8285522	73.50
293.4292908	0.31
321.9358521	0.25
324.4431458	0.36
325.1297607	0.47
326.0101624	0.47
327.9257202	0.88
356.0305481	0.45
363.0199280	1.13
374.1079712	1.68
374.7481384	6.84
376.6503601	100.00
377.4206238	0.23
385.1207886	0.27
386.8347778	0.75
400.8866272	1.14
413.8471680	1.06
414.8949585	2.14
418.1263123	2.14
419.0757446	0.46
423.8103943	0.61
436.8133240	0.24
441.8237610	0.84
443.3178101	0.63
444.1229553	0.90
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	325.1385
Annotation	Pyloricidin D
Peak:m/z	Relative Intensity
102.0754013	0.14
121.2134705	0.08
126.8998413	0.10
130.0445862	0.39
130.8847351	0.03
135.1426239	0.09
145.9790649	25.35
152.1662292	0.14
160.6023407	0.12
164.2255707	0.26
165.9879150	0.21
168.0556335	0.15
180.0003662	0.08
184.0901184	0.07
189.0834351	0.09
194.9705505	0.04
196.0219879	0.04
197.1174774	0.07
202.0926056	0.07
204.8797607	0.04
206.8164978	0.18
208.2592468	0.05
212.0403748	0.92
221.2547302	0.08
232.1638184	0.12
239.9707336	0.05
252.9699097	0.10
256.1586609	0.14
259.8330383	0.20
261.0134277	0.15
268.1134033	15.94
269.2660522	4.44
282.0162659	0.06
286.3874512	0.09
287.1038513	0.18
288.4022827	0.16
290.1098022	0.11
293.0840759	0.20
293.8316650	0.28
297.1095276	0.04
302.1379395	0.07
303.6888123	0.28
304.7605591	0.40
305.5228271	0.06
306.8483582	9.51
307.9098206	100.00
315.3639832	0.10
316.0984497	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	304.0825
Annotation	Melicarpine
Peak:m/z	Relative Intensity
89.9984741	0.05
99.1988068	0.20
100.0461121	0.06
115.0314331	0.16
115.7985916	0.15
119.8952560	0.29
125.9588623	0.25
128.0059814	10.09
129.1088715	0.10
141.0497131	0.04
142.9814606	8.70
144.9049683	0.11
146.1055908	1.27
152.9868164	0.12
155.0344849	0.18
156.9971313	0.34
157.7747955	0.26
159.9246216	10.77
160.8822021	0.11
161.8302460	0.11
166.1482086	0.41
167.0327759	0.44
171.0774384	1.03
172.2266846	0.25
177.0039062	7.54
179.0748291	8.91
184.9967041	1.11
186.0467072	0.35
187.0955658	0.34
188.3188171	0.31
192.2081909	0.04
193.0981750	0.08
197.1367035	0.63
203.2798462	0.05
204.1385193	0.07
205.0724182	0.11
206.0154724	0.06
210.1851501	5.43
213.0421448	1.95
214.1238403	0.16
216.2046509	0.06
217.3080444	0.05
222.1199951	0.08
224.0164185	0.05
225.3357849	0.05
227.1659851	0.42
228.1468811	0.46
231.0764771	2.28
233.3034973	0.06
236.0809021	0.12
242.1013184	1.32
242.7177124	0.15
244.1197510	0.53
245.1712646	0.11
246.0780640	0.19
250.2194214	0.07
251.8193665	0.16
254.1350708	93.94
257.2528381	0.13
258.0725403	0.31
259.0820007	0.23
260.1013794	0.08
261.0433960	0.27
269.3960571	0.27
270.1993408	0.15
272.1260071	100.00
278.3764038	0.07
288.1609192	67.16
306.0065308	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	345.0825
Annotation	Pseudolaroside A
Peak:m/z	Relative Intensity
114.1996384	0.15
137.0378876	3.30
151.2666016	0.03
161.0651245	0.19
164.1049194	0.15
178.2813568	0.44
178.9778900	0.30
180.3217773	0.11
197.1526031	0.04
199.5575256	0.12
208.0302124	0.09
228.0740967	0.09
229.0584106	0.17
240.9230347	0.08
270.9139099	0.20
297.0227966	0.17
299.1525879	100.00
300.2938232	0.43
301.5048523	0.04
302.2778625	0.22
310.1291504	0.06
326.9835510	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	405.1763
Annotation	Unknow
Peak:m/z	Relative Intensity
126.0288086	0.08
128.1643829	0.08
137.0688934	0.30
150.1817932	0.07
154.0361176	0.05
160.9655457	0.19
162.9069977	0.22
164.8712921	0.15
166.1325073	0.13
171.9252625	0.13
181.1372070	0.70
183.0847168	0.94
187.3427734	0.15
194.9013824	0.05
197.2346802	0.18
199.1390076	1.97
209.3110046	0.17
221.1811676	0.10
225.2430725	0.73
231.1187744	0.46
243.0776672	100.00
249.0082703	0.74
251.6022949	0.09
252.4645996	0.36
257.1917114	0.18
261.7264404	0.11
264.4689941	0.05
267.2904663	0.28
274.3101196	0.21
285.2446289	2.15
296.9523010	0.19
300.8599243	0.13
303.7965698	0.06
307.0892944	0.43
309.1566467	0.55
310.9415894	0.08
315.1076660	0.63
317.1593018	0.07
318.6812439	0.19
327.4359741	0.11
331.1620483	0.06
334.6991577	0.07
341.5976868	0.15
343.4009705	0.21
344.5631104	0.57
345.2083740	4.84
347.1698914	0.25
351.5749817	0.10
357.4643860	0.15
359.2643127	3.88
360.1899719	0.33
361.2753906	0.41
363.1514587	0.15
365.6305847	0.08
369.5563660	0.12
375.3550720	0.06
385.0782776	0.09
386.1269226	0.44
387.2752686	2.70
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.0876
Annotation	Grevilloside F
Peak:m/z	Relative Intensity
112.6389771	0.06
122.9866638	0.15
136.9311829	100.00
147.0264893	0.05
151.1510925	0.04
153.0127258	0.19
179.0445862	0.18
192.2308807	0.51
195.1618347	0.08
210.1439514	0.42
225.2203369	0.08
234.9083862	0.14
235.6300659	0.07
241.3242798	0.07
245.2186890	0.20
250.1809692	0.18
250.9428101	0.10
253.4424438	0.36
254.2560425	0.14
255.2208252	0.19
257.3680420	0.05
261.1810913	0.03
265.3023682	0.23
279.2933960	0.17
281.2249146	1.07
282.1055298	0.08
294.1915283	0.09
295.1477051	0.35
296.8543701	0.61
298.1438293	0.13
304.9616394	0.13
309.3449402	0.05
320.9292297	0.05
322.3804321	0.13
323.2023621	1.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0855
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
94.83261871	2.07
97.20277405	0.85
102.99823	2.65
107.1474762	1.67
109.2669983	2.05
119.0086517	5.72
120.8795776	2.05
124.290329	2.18
129.0102081	11.74
147.2027588	1.88
149.2963562	2.69
150.9674683	100.00
152.0885468	2.28
154.9697723	1.65
159.2711487	4.97
163.0437775	2.78
165.1033173	4.87
166.1991119	1.66
169.0121002	2.51
171.2050934	1.14
178.1306915	0.86
179.1493988	3.43
180.1418457	4.34
183.258194	4.75
185.2733612	2.22
189.080719	3.00
194.1349945	3.93
197.3654175	3.37
198.8425751	1.30
206.6413422	1.46
207.2639008	7.21
209.0836182	0.94
211.2041168	7.86
211.9844818	1.15
214.8618317	6.28
217.2106934	10.26
225.134964	6.87
234.0526123	2.97
235.1964111	57.04
238.0015411	8.81
239.1727753	1.38
251.1483154	3.88
252.1036224	3.86
253.0946655	79.42
254.0741577	16.69
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	332.1333
Annotation	5'-O-beta-D-Glucosylpyridoxine
Peak:m/z	Relative Intensity
96.0424118	0.02
105.8631744	0.11
108.0330048	0.84
109.1570511	0.03
124.0127106	0.14
134.0367126	0.49
135.9548645	1.48
144.2624207	0.01
145.0257874	0.03
147.9692230	0.03
150.1797180	0.13
152.0028992	4.84
154.0012207	0.08
170.0466919	6.09
184.6658630	0.03
186.9688568	0.03
190.0010529	0.01
194.3014832	0.03
208.2272339	0.04
212.1352844	0.04
224.9186707	0.03
229.0062256	0.03
230.5052490	0.01
232.2358704	0.06
233.1481628	0.03
235.8084412	0.06
245.1164246	0.02
253.9089050	0.04
268.2938843	0.02
270.4844666	0.01
278.0703735	0.10
286.4878540	0.04
292.4384766	0.09
296.1763916	0.38
314.1711426	100.00
314.7711487	0.29
322.9324951	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	527.1437
Annotation	Unknow
Peak:m/z	Relative Intensity
209.4522400	0.04
261.3358154	0.02
287.3986206	0.06
298.0587769	0.05
303.3049927	0.01
305.2265015	0.02
310.4357910	0.05
322.3657837	0.03
329.5171509	0.30
341.0578613	0.14
352.9106445	0.06
355.2416992	0.03
365.3623047	0.10
366.2871704	0.03
379.2098389	0.09
399.6389160	0.10
403.3208618	1.58
404.2906494	0.03
409.0581665	0.04
423.2110596	0.90
427.0679932	0.12
429.3411865	0.02
431.3748779	0.07
435.0513916	0.03
439.1043701	0.08
441.2569580	14.09
441.9203491	0.01
447.4035645	0.02
449.7878418	0.24
451.3327637	0.03
459.3909302	0.09
466.3131714	0.03
469.0913696	0.03
481.1788330	0.35
483.2559814	100.00
484.1476440	0.02
489.1774292	0.13
490.5219116	0.14
491.2290649	0.48
491.9248657	0.04
507.3921509	0.08
509.1599121	3.93
511.9959106	0.04
513.0590820	0.08
527.8485718	0.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	148.0601
Annotation	3-Aminopentanedioate
Peak:m/z	Relative Intensity
83.9813385	0.45
101.9538422	15.89
129.9265747	100.00
130.9797821	4.00
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
190.9454498	0.06
206.9833984	0.12
274.7381287	0.28
290.6428223	1.29
341.8438721	0.06
358.7711792	0.88
374.0686646	0.14
374.8000488	0.29
402.9859009	0.21
406.8728638	0.05
418.1328125	0.05
420.6376953	0.11
436.8685913	0.28
442.6192627	11.66
443.2763062	0.13
444.6485596	2.16
447.0745239	0.13
448.4049072	0.09
458.5648193	7.21
459.3134155	0.10
474.7868652	2.51
480.9244995	0.57
490.8310547	0.24
498.8187256	0.14
502.3091431	0.04
503.9596558	1.75
504.6349487	10.33
505.2617798	0.14
505.8977661	0.15
511.6815186	0.27
512.8897095	0.15
524.0636597	0.11
524.7255859	1.01
526.6561890	100.00
533.9282837	0.16
541.8877563	0.11
542.6647339	2.38
545.6939087	0.23
546.6534424	0.68
550.1270142	0.17
550.8045654	1.76
564.0530396	2.45
564.7150269	7.18
565.4123535	0.23
566.2696533	0.06
568.8533325	0.04
581.9226685	0.10
587.2821045	0.29
593.0766602	0.71
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	483.1542
Annotation	Unknow
Peak:m/z	Relative Intensity
143.0160828	0.23
152.8153534	0.62
165.0140228	0.96
170.9960022	0.02
174.0518951	0.06
175.1236267	0.11
179.0132599	0.09
180.9967804	0.19
183.3864899	0.06
185.5375061	0.04
192.9052734	0.06
199.1577454	1.55
205.0161743	0.37
207.0115356	0.03
213.1555939	0.04
222.9788513	0.43
237.3827209	0.03
241.1674500	0.50
254.0292969	0.06
255.6583557	0.06
264.9343567	0.13
269.3570862	0.48
279.3584900	0.14
283.1360779	4.19
290.9550476	0.10
294.6282959	0.11
297.1947937	0.11
313.0703735	0.33
316.2824402	0.06
318.9930725	0.07
320.3565063	0.13
321.1966248	0.07
323.0490112	0.04
325.2891846	0.51
330.9708862	0.05
334.0624695	0.03
335.1531372	0.05
343.2259521	21.41
344.3240356	0.74
351.1343994	0.06
361.3155823	31.56
362.3696899	0.40
363.0983582	0.02
366.2468262	0.03
377.3043213	0.05
379.2752380	0.37
381.1816711	0.08
382.9802246	0.05
383.7124023	0.05
385.4134216	0.40
387.0542297	0.31
392.0490417	0.23
401.1223450	0.10
403.2879333	100.00
404.2856140	2.66
405.2110596	0.41
406.3932800	0.09
411.0629272	0.10
423.2312622	31.29
424.2530212	0.88
427.5563049	0.10
436.8568420	0.26
438.0576782	0.17
439.3638306	2.79
441.1609192	0.30
446.6914368	0.12
447.3713074	0.14
448.2156982	0.11
454.1707764	0.14
462.7371216	0.13
465.3783569	0.45
466.3184509	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	311.22
Annotation	trans-EKODE-(E)-Ib
Peak:m/z	Relative Intensity
94.74816895	0.71
109.0818939	0.27
111.0430756	0.26
119.1110916	0.72
125.0656967	1.48
138.9642029	0.42
140.5091553	0.71
152.8225708	0.30
154.9989319	0.63
164.1529236	1.49
166.9896698	2.44
169.0324097	0.52
175.1849976	1.10
177.0984192	1.15
181.0510406	0.90
183.1058044	2.83
185.006134	0.82
193.1147614	0.67
195.2110901	0.95
197.0978851	1.66
208.0215454	0.54
209.12677	0.85
211.1746826	3.05
212.3028259	0.31
212.9893494	0.73
215.285675	0.48
222.0875854	0.69
223.3128967	1.03
224.2950745	1.12
225.1563721	2.67
227.0233459	1.28
233.0912476	1.06
235.0961609	1.11
238.028656	2.30
239.2833252	0.44
241.0489807	1.27
247.5896606	1.31
249.0112915	1.15
251.0052795	1.09
253.2376709	6.52
256.9301758	0.89
265.112915	0.98
267.1144409	0.69
269.1153564	0.92
270.0454712	0.53
270.7423401	0.69
275.266449	10.19
283.294342	1.88
293.2137451	100.00
294.1574097	0.58
296.9333801	1.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	390.1338
Annotation	2-(Glutathion-S-yl)-2-methylbut-3-en-1-ol
Peak:m/z	Relative Intensity
116.9853363	0.03
128.0022583	0.10
133.9225769	0.09
135.0916748	0.12
143.0737152	0.07
146.0961304	0.05
150.8449402	0.02
173.0100708	0.11
177.0211182	0.37
179.1521301	0.71
189.4494324	0.07
191.1617889	0.11
193.1893921	0.03
197.1810913	0.02
208.9484863	0.05
213.1598816	0.04
213.8968353	0.06
215.6273804	0.11
217.0297241	1.57
225.8851318	0.07
227.0201416	0.02
228.0885315	0.06
235.8802795	0.08
238.0910339	0.02
240.0605164	0.05
241.3818359	0.02
242.2651062	0.05
254.0912476	2.75
261.1877441	0.06
272.1651611	3.40
281.8537903	0.05
288.1498413	4.37
301.3604431	0.08
302.3869019	0.05
306.1003113	100.00
307.2149353	0.11
309.2663269	0.15
310.1732178	0.03
321.4219360	0.05
326.2879944	0.10
327.1137085	0.04
341.0693970	0.02
344.2734375	0.02
345.7600098	0.29
347.1724243	0.18
354.2609863	0.11
360.9823303	0.03
371.1345825	0.08
372.0984802	2.60
373.2904968	0.30
374.2420959	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1016.95
Annotation	Unknow
Peak:m/z	Relative Intensity
332.3551636	0.66
447.1500549	1.44
475.4300537	0.60
492.1885376	0.94
606.4416504	0.60
622.2048340	1.22
658.9029541	1.50
663.4697876	0.35
667.3804932	0.29
679.3093262	0.51
687.7058105	0.81
691.1119385	0.97
707.6170654	0.56
728.1934814	3.50
785.6130371	0.35
886.5196533	0.79
890.8533936	0.35
927.6142578	1.09
928.6124268	1.22
951.9738770	3.79
958.6857910	2.07
968.2250977	0.54
971.4178467	0.35
973.7053223	6.22
988.7192383	2.18
990.1140137	9.55
993.0174561	1.29
995.0411377	7.12
995.8569336	0.98
998.7805176	8.37
999.6761475	1.87
1005.4244380	5.96
1045.6185300	2.74
1060.8637700	4.71
1076.1564940	4.29
1081.5496830	6.59
1084.4938960	1.47
1088.1484380	5.97
1090.1071780	0.63
1097.3487550	4.07
1103.4765620	0.60
1105.1013180	3.11
1107.9202880	0.91
1112.6645510	3.14
1114.4788820	2.12
1117.7359620	0.58
1119.3305660	3.58
1120.3159180	4.35
1126.3576660	3.67
1131.5310060	2.25
1132.7740480	6.61
1133.9479980	1.44
1137.1594240	0.51
1140.3216550	5.79
1142.7839360	2.11
1143.9250490	1.46
1145.8875730	2.58
1149.4202880	2.09
1150.6362300	3.29
1151.6745610	3.43
1152.4160160	0.41
1153.3931880	0.72
1154.7015380	0.78
1159.4082030	1.34
1162.1447750	2.48
1163.0847170	0.91
1163.7224120	1.65
1164.9511720	21.27
1166.8806150	11.04
1168.5050050	11.25
1170.5710450	13.07
1171.9040530	8.30
1173.6875000	22.65
1174.7283940	9.84
1176.5687260	1.34
1177.6164550	1.62
1178.3499760	1.31
1179.1804200	3.24
1179.8217770	0.71
1182.4340820	11.25
1183.7514650	0.38
1185.4583740	1.26
1187.8890380	24.28
1189.0576170	7.69
1190.1103520	1.36
1191.4230960	42.40
1192.3317870	4.60
1193.2983400	2.29
1194.8918460	19.89
1197.6230470	0.32
1198.3634030	4.99
1200.1944580	5.22
1204.8095700	0.92
1207.2835690	1.87
1211.2230220	0.66
1220.1132810	5.69
1241.8691410	1.28
1242.7427980	2.48
1260.1617430	4.07
1266.4310300	1.42
1267.5816650	0.82
1268.4765620	2.75
1271.2338870	2.63
1274.5096440	5.66
1287.4555660	5.02
1297.4805910	2.18
1298.1491700	6.50
1310.8336180	2.22
1317.7016600	2.59
1324.7569580	1.80
1326.0015870	1.37
1334.4812010	4.24
1340.6231690	2.73
1345.6560060	0.48
1350.0515140	4.22
1351.3197020	3.18
1353.8162840	2.46
1360.6219480	2.68
1362.4947510	3.14
1367.0838620	2.99
1369.1031490	4.74
1369.9659420	1.85
1372.5694580	6.38
1379.5098880	1.45
1386.6994630	2.61
1389.4882810	3.82
1391.6970210	2.65
1394.1127930	11.42
1396.9061280	6.84
1398.6737060	2.51
1399.7463380	6.02
1400.7678220	0.51
1401.4512940	1.28
1404.4102780	3.40
1405.3706050	1.06
1407.1744380	2.34
1409.4989010	2.93
1410.3267820	5.53
1410.9277340	0.51
1416.0853270	2.15
1421.1672360	0.76
1422.7237550	13.78
1425.2657470	1.76
1426.4925540	6.43
1427.8096920	9.18
1430.4327390	5.28
1431.9110110	7.26
1434.9597170	12.18
1435.6229250	0.29
1436.6243900	0.53
1437.8355710	2.08
1440.9035640	2.46
1442.8612060	2.77
1444.9866940	9.36
1447.7862550	2.00
1449.1440430	3.62
1449.7453610	1.79
1452.2792970	1.28
1453.0213620	7.31
1456.2923580	10.14
1460.5529790	2.65
1461.4910890	10.84
1465.2377930	1.28
1466.3302000	3.25
1471.4880370	5.10
1475.2156980	1.68
1494.1047360	2.19
1495.2700200	3.36
1517.4155270	4.63
1521.9729000	1.20
1526.4538570	0.26
1528.2290040	4.52
1553.5997310	4.57
1554.4000240	0.57
1557.0251460	2.06
1559.0882570	2.35
1572.9810790	1.89
1576.8858640	0.47
1579.4407960	1.06
1591.7878420	1.99
1626.6632080	0.88
1667.2779540	0.48
1673.7609860	3.03
1683.9473880	1.91
1751.7100830	1.65
1782.6883540	0.72
1788.5915530	0.44
1799.6439210	1.95
1804.8067630	1.83
1809.9035640	1.02
1819.3956300	5.58
1847.3306880	1.61
1851.5946040	1.48
1857.1485600	1.34
1860.1437990	2.24
1887.6823730	37.70
1897.2945560	0.41
1898.5604250	13.72
1907.3890380	3.46
1908.9278560	0.82
1910.0988770	16.59
1913.5740970	9.46
1927.1994630	13.10
1929.2385250	2.15
1936.7740480	31.18
1944.6390380	53.99
1945.2418210	0.45
1948.0319820	8.27
1956.6949460	6.16
1960.1433110	11.32
1961.9927980	6.76
1967.9642330	0.68
1979.4025880	100.00
1982.0943600	37.97
1991.2751460	23.05
1993.0217290	1.61
1998.7564700	2.64
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	834.9003
Annotation	Unknow
Peak:m/z	Relative Intensity
256.1604309	0.19
273.3015137	0.35
273.9856873	0.04
276.2546997	0.14
284.0743408	0.27
291.1839294	0.76
298.0504456	0.56
307.2363892	0.17
308.4190369	0.16
315.1914062	0.25
325.2438660	0.21
343.2108154	0.40
349.3209839	0.34
361.2322388	0.22
378.0979004	0.32
379.4536743	0.41
384.0487671	0.07
385.2188416	0.12
386.4964600	0.09
394.2868652	0.08
402.2305298	0.06
412.3369141	1.26
413.4949341	0.35
422.1350098	0.07
436.3377075	0.29
440.8850098	0.13
454.3294067	0.44
456.5560913	0.24
459.4480591	0.13
465.3770752	0.20
471.7086792	0.15
478.9654541	0.22
485.1176147	0.08
488.4612427	0.46
489.6940308	0.11
493.5117188	0.20
506.5801392	0.13
507.3825684	0.16
511.7560425	0.33
512.4812622	0.25
516.2349854	0.07
521.4692383	0.31
530.5128784	0.25
536.5175781	0.35
546.0005493	0.23
547.2205811	1.05
555.4825439	0.05
556.4613647	0.25
557.2572021	0.23
561.8430786	0.13
562.7376099	1.01
564.3251343	2.11
565.1178589	0.36
571.0892334	2.19
572.4160767	0.42
573.6212769	0.17
575.5019531	0.10
581.3076172	0.11
582.3167114	1.55
583.5236206	0.79
592.4105225	0.14
593.3489380	1.98
598.2459106	0.11
606.4756470	0.14
610.8287354	0.18
616.7006226	0.09
622.4579468	0.11
628.7899780	0.16
637.3234253	1.15
637.9921265	1.58
639.2645264	0.29
640.6536865	0.23
655.5877075	0.98
656.9113159	0.16
657.8620605	0.73
658.5238647	0.41
660.0200195	0.07
662.8291626	0.08
664.6022339	1.65
674.4638062	0.82
675.3731079	1.19
676.5016479	0.12
677.3810425	0.09
678.4147339	0.41
679.6869507	0.14
681.4955444	0.09
682.5994873	0.09
687.1125488	1.14
688.5795898	0.67
689.1921997	0.34
692.3201294	12.05
693.3869629	6.16
694.5782471	1.13
695.4057617	0.25
698.4468994	0.17
700.4393921	0.57
701.6259766	0.14
705.4633179	0.46
706.8817749	0.38
708.0397339	0.07
710.4630737	0.16
711.7078857	0.10
715.2446899	0.68
720.5009155	0.10
728.9385376	0.26
731.6134644	2.37
732.6119995	1.22
733.5098267	0.75
734.8467407	0.44
736.2378540	0.14
736.9935913	0.91
741.1804810	1.24
742.5563965	0.12
743.9483032	0.17
744.9423218	0.14
747.6320190	0.17
750.2551880	0.20
754.7595825	1.51
755.3997192	0.15
757.0599976	0.25
758.4834595	0.30
760.7155151	4.22
761.4719849	0.28
762.5324097	1.94
764.3187866	1.89
765.0444336	0.61
766.8483276	0.53
768.5488892	0.12
770.9526978	0.65
772.1245728	0.36
773.2502441	0.07
774.8777466	0.21
780.1729126	9.43
781.3319702	0.17
784.4916382	19.99
785.5204468	1.08
786.5417480	0.44
787.2609863	0.37
788.8928833	5.54
790.2518311	3.14
791.3943481	1.09
792.5679932	0.78
793.6960449	0.60
794.7577515	1.26
795.4968262	0.68
796.9546509	0.24
798.0798340	0.81
799.9532471	0.39
801.9728394	0.09
804.6248779	0.62
805.3518677	0.97
809.1630249	18.45
810.4156494	1.38
814.8248291	0.28
815.6713257	1.38
816.8167725	1.79
817.6770630	0.22
819.8424683	2.42
820.4865723	2.84
821.4531250	2.47
822.1317749	4.48
823.3318481	0.46
826.4035645	0.63
843.5859985	0.63
844.2847900	1.44
849.8566284	2.40
850.7380371	0.41
852.6213989	0.08
856.1676025	0.52
862.4313354	3.43
863.5274048	3.68
864.1920776	0.44
865.2482300	1.29
866.1917114	0.22
867.3143311	0.89
869.3993530	0.09
873.6037598	0.77
875.0451660	0.16
876.8500366	13.66
877.6583252	3.62
878.4165649	0.76
879.6692505	0.30
883.0852661	100.00
884.7476196	1.19
885.8066406	0.62
887.0073853	0.32
888.5950317	0.53
889.5474243	0.14
890.6817017	0.41
892.7760010	0.60
896.7539673	0.12
897.5709839	0.61
898.7978516	1.09
899.4291382	0.03
908.1157227	0.25
912.4426880	0.29
919.6525269	4.86
920.5210571	0.52
921.5720825	0.10
922.2202759	0.11
924.3871460	0.08
925.6489258	19.39
926.4942017	2.21
928.1181641	0.26
932.5124512	0.22
934.4292603	0.23
936.0429688	0.25
940.0963745	0.31
943.3247681	0.22
944.7599487	0.45
946.6435547	0.50
947.2973022	1.14
950.0286255	0.10
952.7798462	0.78
954.5302124	0.18
955.5581665	1.34
956.6317749	0.24
960.2767944	0.39
961.3906250	0.14
962.9199829	0.18
965.6849976	0.09
974.4542847	0.43
977.6940918	0.06
978.7161255	0.46
981.7061157	0.90
983.3170776	1.79
984.6240234	0.96
987.8139038	18.35
988.6192017	2.56
991.4299927	1.47
993.4620972	0.10
994.3933105	0.20
995.4454956	0.29
997.0076294	0.79
997.6831055	1.84
998.3850098	0.45
1001.6716310	0.43
1004.3881230	0.67
1006.2495120	1.93
1007.2670900	0.80
1009.2844850	0.24
1010.7854000	1.95
1011.4320680	0.03
1016.7595830	12.94
1017.5778810	0.85
1018.5480350	0.07
1019.5949100	0.28
1022.5173950	0.06
1023.7536010	0.38
1032.9184570	23.14
1033.7271730	7.67
1034.5271000	0.83
1039.6838380	2.59
1041.5579830	0.36
1045.4636230	4.95
1046.3258060	0.66
1047.0476070	0.19
1047.7622070	0.49
1051.4215090	8.67
1052.4492190	1.09
1053.4743650	7.27
1055.4802250	0.34
1058.8071290	2.15
1059.4693600	28.60
1060.3920900	3.92
1061.2215580	0.26
1061.9964600	0.23
1063.4624020	0.57
1064.5870360	1.70
1068.7928470	0.46
1072.5749510	1.17
1078.4195560	3.59
1080.1821290	0.11
1081.9337160	0.27
1090.0206300	0.66
1091.2233890	1.10
1092.8137210	0.32
1096.9348140	0.48
1097.5786130	1.08
1099.3804930	2.20
1100.5063480	1.82
1110.5329590	0.12
1112.8387450	0.19
1122.3408200	0.41
1123.5778810	0.54
1140.5595700	0.39
1141.6707760	0.64
1145.6359860	2.71
1146.6140140	2.70
1147.4248050	0.30
1148.9272460	0.09
1154.6571040	0.43
1155.5275880	0.27
1163.8894040	1.93
1165.1755370	0.53
1181.7407230	0.21
1203.0766600	0.09
1211.5372310	0.15
1218.7675780	0.06
1220.8825680	0.07
1225.4130860	0.37
1230.7204590	0.56
1241.9047850	0.15
1257.4844970	0.15
1267.5169680	0.36
1273.5050050	0.15
1274.7005620	0.21
1304.5271000	0.18
1323.5323490	0.14
1327.8333740	0.08
1357.9957280	0.28
1359.0271000	0.59
1367.7864990	0.12
1381.7976070	0.32
1409.9912110	0.09
1416.4364010	0.12
1422.2683110	0.16
1458.8431400	0.06
1509.4420170	0.13
1525.2115480	0.05
1542.6903080	0.26
1543.4888920	0.19
1545.2130130	0.19
1588.9178470	0.06
1593.4249270	0.17
1634.6809080	0.24
1636.2572020	0.18
1726.8674320	0.09
1738.6019290	0.05
1739.7977290	0.14
1753.9332280	0.08
1761.2653810	0.11
1782.7940670	0.06
1788.6262210	0.05
1804.1475830	0.04
1807.7772220	0.14
1844.0360110	0.23
1849.4234620	0.45
1860.4519040	0.33
1867.2374270	0.10
1878.2379150	0.69
1885.0510250	0.27
1886.5726320	1.05
1887.2122800	0.31
1891.5123290	0.23
1894.1018070	0.15
1897.0134280	0.27
1902.9813230	0.04
1906.3729250	0.31
1909.8165280	0.21
1915.6661380	0.69
1928.8034670	37.31
1932.2508540	0.78
1945.7139890	2.71
1950.3636470	1.10
1952.5900880	0.04
1957.4425050	3.01
1958.9694820	0.72
1960.4132080	0.36
1964.6251220	19.27
1968.1877440	0.09
1972.0777590	0.06
1973.9136960	0.38
1987.6833500	0.27
1991.4107670	8.38
1992.6407470	0.80
1994.6397710	0.08
1995.8594970	0.89
1999.4112550	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	377.1816
Annotation	Unknow
Peak:m/z	Relative Intensity
111.6759338	0.04
112.9783936	1.61
118.9791641	0.23
123.2113342	0.06
124.0815353	0.04
125.0664139	0.26
127.9236526	0.05
128.9669495	0.14
130.8667908	0.06
143.0763092	0.28
148.5706787	0.04
153.0414734	0.03
159.0489197	0.57
161.0266113	1.74
169.0949860	0.13
171.2169037	0.13
178.5310974	0.07
191.1103210	0.06
197.1091461	0.87
201.0908356	0.05
203.2283173	0.13
215.2004547	5.41
222.9388428	0.23
237.3492126	0.08
257.1558228	0.36
266.9063416	0.13
269.0882568	0.39
293.3913879	0.13
305.1297913	0.11
311.3253479	0.12
315.4711914	0.23
317.3664551	0.06
333.2016296	0.11
341.1975708	1.73
345.1445312	0.05
359.2426758	100.00
360.3992004	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	437.2136
Annotation	Unknow
Peak:m/z	Relative Intensity
129.0436707	0.18
146.0732880	0.56
188.7625732	0.09
218.0838318	100.00
221.2132568	0.05
234.0168762	0.04
241.0861816	0.15
271.0662842	0.21
272.1092529	0.68
279.9448853	0.11
301.2711792	0.08
307.2986145	0.03
308.2325439	0.06
319.2177124	0.20
337.0569458	0.03
345.4332275	0.17
363.1421509	0.06
373.1834412	0.30
391.2098694	0.13
408.4115295	0.05
417.1340637	0.09
419.0600891	0.03
436.8583984	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	976.7
Annotation	Unknow
Peak:m/z	Relative Intensity
358.2664795	0.16
364.0854492	0.28
371.3813171	0.14
384.2713013	0.05
401.2697144	0.18
460.2399292	0.18
466.1323853	0.18
470.0524902	0.14
474.3015747	0.08
503.6706543	0.12
514.1851196	0.13
541.5146484	0.05
546.9675903	0.49
613.5935669	0.17
623.2334595	0.07
636.3994751	0.10
645.2015381	0.08
652.6553345	0.16
659.3092651	0.07
717.6582642	0.34
737.5793457	0.15
763.4379272	0.27
774.5532227	0.32
779.4442749	0.19
796.0820923	0.35
797.5071411	0.23
798.4441528	0.10
813.6920776	0.05
847.1918335	0.13
849.9160767	0.10
855.6583862	0.21
875.4735107	0.16
888.7733765	0.55
896.5009155	0.05
915.8875122	0.21
916.8610840	0.12
918.9459839	0.77
932.4428101	0.41
934.2568359	3.14
935.9934692	1.25
937.1846313	1.31
938.0505981	1.06
939.6853638	3.51
942.1689453	6.50
943.3596802	2.19
943.9976196	2.50
944.8228149	3.00
945.9071655	2.07
948.4375610	1.28
951.3125610	1.77
952.2415161	3.35
953.5368652	9.16
954.3100586	0.09
956.1231079	26.74
957.0329590	0.73
958.4338379	3.82
959.3777466	6.15
961.0798340	0.67
961.8996582	2.38
963.3249512	3.07
964.2388306	2.92
965.6067505	4.13
966.8789673	0.69
991.3669434	0.30
998.6549683	0.23
1010.1679690	0.21
1012.1184690	0.46
1013.0758670	0.14
1037.9019780	0.37
1041.6281740	2.36
1043.8684080	0.12
1045.5837400	0.19
1049.8117680	0.37
1050.7004390	0.17
1052.1688230	0.85
1054.7729490	2.95
1055.8161620	1.59
1057.3118900	1.02
1058.9007570	2.01
1059.7771000	3.91
1060.7028810	0.77
1062.9630130	9.16
1063.9162600	0.21
1065.2386470	1.85
1065.9587400	8.77
1066.6688230	0.22
1067.7561040	0.73
1068.4863280	0.98
1069.9614260	3.63
1072.1583250	2.30
1072.8375240	0.30
1074.2817380	0.67
1075.1101070	3.05
1076.4152830	4.78
1077.6004640	12.46
1078.3666990	2.16
1079.0119630	0.23
1080.5633540	3.54
1081.5878910	6.85
1084.6235350	10.12
1085.4996340	1.91
1086.3295900	0.21
1087.5516360	2.82
1088.3752440	2.56
1089.8664550	3.62
1090.5069580	0.40
1091.1574710	1.59
1093.0043950	4.86
1094.6246340	1.02
1095.9396970	2.73
1096.9252930	4.33
1097.7944340	1.80
1098.7429200	11.47
1099.4780270	6.50
1100.5825200	4.33
1101.6992190	26.08
1102.8634030	3.37
1103.6110840	4.08
1104.5019530	3.10
1105.6090090	2.20
1106.7558590	2.10
1107.9248050	1.15
1108.9261470	4.52
1109.6086430	3.85
1110.3956300	3.20
1112.2253420	31.26
1112.8573000	2.83
1113.5512700	0.77
1115.2171630	100.00
1116.2806400	2.84
1117.0378420	2.29
1118.1767580	18.69
1119.9307860	3.71
1121.6899410	6.03
1122.5991210	3.87
1123.5965580	2.34
1124.7937010	1.13
1125.8701170	0.21
1127.8140870	1.89
1130.5433350	4.42
1132.1623540	1.17
1133.6269530	5.90
1134.3486330	1.93
1136.7641600	15.56
1137.6247560	0.12
1139.7939450	1.34
1141.7414550	0.56
1152.6745610	1.07
1161.6518550	0.94
1169.2491460	0.62
1172.3154300	0.61
1176.1628420	0.21
1177.9599610	0.07
1179.1693120	0.66
1182.1524660	0.51
1185.0084230	0.88
1190.2420650	0.23
1191.9606930	1.70
1193.6079100	0.77
1194.2358400	0.90
1195.3028560	1.06
1196.6679690	0.22
1198.2565920	0.87
1199.1870120	1.63
1200.9589840	0.28
1202.5750730	0.99
1203.9412840	0.14
1206.5793460	0.99
1208.1320800	2.15
1209.5793460	1.93
1210.4812010	1.38
1211.3966060	0.47
1213.9501950	0.89
1215.1679690	0.50
1216.0576170	0.65
1218.1274410	0.88
1222.9438480	1.08
1225.6608890	1.49
1226.9754640	0.66
1228.7668460	1.83
1229.4860840	1.52
1230.7064210	0.86
1234.3903810	0.93
1236.5323490	0.83
1237.4533690	0.98
1239.0146480	0.41
1241.1149900	3.53
1242.2211910	1.56
1245.1662600	1.32
1245.8513180	0.98
1246.6116940	0.70
1249.0253910	2.30
1249.8729250	1.28
1251.2680660	1.33
1252.7751460	1.38
1254.3347170	1.97
1256.7542720	1.02
1257.7403560	1.99
1259.1154790	0.07
1260.4245610	1.82
1261.1643070	0.13
1261.8760990	0.79
1262.8305660	2.85
1264.7078860	0.95
1265.3471680	2.93
1266.0527340	1.96
1267.7803960	0.77
1269.1794430	4.80
1270.1770020	2.18
1270.9929200	1.38
1271.8552250	1.49
1272.6593020	0.68
1273.6679690	0.58
1275.7900390	3.06
1277.3225100	1.09
1278.3787840	5.22
1279.7601320	1.87
1280.6400150	0.45
1281.7799070	1.96
1283.4156490	2.75
1284.2681880	1.19
1285.0753170	2.31
1287.3670650	0.27
1289.1688230	1.80
1290.7933350	0.12
1292.7166750	4.39
1293.4414060	0.45
1295.6583250	2.63
1297.6124270	1.79
1298.7320560	1.33
1300.8724370	2.83
1301.7513430	1.92
1302.3554690	0.14
1303.4526370	1.92
1304.6705320	1.94
1305.3819580	0.09
1306.8846440	3.45
1308.7867430	1.77
1310.7896730	2.59
1311.7447510	1.81
1312.9620360	0.44
1315.5876460	1.32
1317.4732670	0.67
1318.2010500	1.20
1321.2390140	2.07
1323.4801030	0.34
1325.6536870	0.41
1326.3573000	0.46
1328.6838380	0.14
1329.7977290	2.71
1330.7476810	0.38
1333.6976320	0.81
1338.2655030	0.51
1340.2293700	1.01
1344.3820800	0.11
1345.9591060	0.40
1347.3249510	0.84
1349.3763430	1.37
1351.1500240	0.34
1356.8250730	0.78
1358.8797610	0.22
1361.7445070	0.76
1362.9140620	0.33
1365.5653080	0.72
1372.5367430	0.16
1374.6053470	0.83
1382.5621340	1.09
1398.4017330	0.27
1400.3189700	0.64
1413.4722900	0.18
1422.7930910	0.28
1424.4830320	0.71
1428.6810300	0.98
1430.6419680	0.19
1433.6972660	0.59
1438.9965820	0.53
1442.8082280	0.77
1443.7200930	1.55
1448.6779790	0.07
1466.6674800	0.12
1479.5494380	0.69
1484.8503420	0.42
1493.3533940	0.55
1498.9305420	0.78
1505.6470950	0.21
1515.6785890	0.85
1521.5789790	0.52
1530.8300780	0.47
1536.2911380	0.60
1537.7620850	0.92
1544.9520260	0.55
1549.1473390	1.46
1551.8538820	0.70
1571.7535400	0.25
1592.9234620	1.13
1598.2938230	1.05
1610.4217530	0.13
1611.8861080	0.26
1616.0706790	0.64
1638.6937260	0.05
1661.5163570	0.67
1670.6940920	0.08
1799.5550540	0.05
1807.8160400	0.52
1823.0235600	0.22
1823.8040770	0.10
1827.7501220	0.22
1829.9245610	0.12
1835.7393800	0.15
1849.2279050	0.05
1864.5892330	0.15
1865.8781740	0.41
1894.3352050	0.71
1902.1467290	0.77
1914.7078860	0.42
1916.7667240	0.22
1929.7204590	0.44
1934.4943850	2.09
1946.0045170	0.51
1948.5516360	0.09
1950.3382570	0.14
1956.4924320	0.16
1962.2785640	13.39
1970.7424320	0.55
1971.4251710	0.18
1974.6379390	0.34
1976.8245850	0.71
1978.4432370	0.07
1980.7054440	1.46
1983.2696530	0.33
1985.6647950	0.65
1988.6781010	0.08
1992.3829350	0.25
1993.3200680	0.21
1997.2248540	0.06
1998.9342040	8.21
1999.9597170	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	543.1309
Annotation	Galactotriose
Peak:m/z	Relative Intensity
137.0795288	0.15
184.0078125	0.72
221.9391479	0.67
225.2255249	0.12
260.0446777	0.26
296.3255920	0.24
336.6952515	0.16
359.8904419	0.19
363.3106079	0.79
381.1019897	100.00
381.8948975	0.86
389.9789429	0.12
397.0197144	1.34
407.0116577	0.33
409.9265747	0.29
414.2795410	0.18
423.4269409	0.24
449.6815796	0.41
521.5095825	0.41
525.1249390	0.67
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
108.8379822	0.34
129.8689728	0.39
133.9042969	2.06
145.8180847	0.13
146.9483795	2.49
172.8410797	0.78
198.9076080	0.23
202.1528931	0.38
206.9591522	0.35
209.6023102	0.22
213.1104584	0.22
216.9335175	6.16
218.0313110	1.79
221.6857147	0.27
227.0960236	21.49
227.9343109	63.03
228.6536102	0.24
234.9878693	2.81
244.9675446	100.00
245.9507446	48.91
248.1783905	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	539.14
Annotation	Galactotriose
Peak:m/z	Relative Intensity
161.1545715	0.13
179.0874329	1.09
221.1719971	0.57
250.3890381	0.27
251.1150055	0.05
280.2449341	0.02
281.0419006	0.36
311.1690674	0.05
323.2022095	0.56
341.0861816	2.16
342.4104004	0.02
343.2776489	0.05
355.1378174	0.02
356.2298584	0.01
359.2512817	0.11
377.1871948	10.59
383.3054810	0.95
406.0377197	0.03
418.3832397	0.01
424.4409180	0.02
442.3885498	0.09
443.0821533	0.48
453.3595581	0.02
485.2638550	0.02
503.2440796	100.00
503.8449097	0.34
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	407.0651
Annotation	Unknow
Peak:m/z	Relative Intensity
119.0002747	0.05
127.9651413	0.08
138.9037781	0.10
143.0576782	0.15
145.1271210	0.04
146.3722687	0.05
163.0359039	0.13
165.0975494	2.30
178.8574219	0.18
187.0389404	0.09
189.1272888	0.03
189.9441528	0.02
204.7413483	0.04
207.1471100	0.89
210.1690369	0.03
212.7309570	0.13
215.2680664	0.09
217.1293182	0.03
219.1087494	0.19
224.1624603	0.05
227.4011536	0.06
233.0830383	0.11
237.1419373	0.20
241.0781860	0.41
244.9987793	100.00
245.6090088	0.28
249.1210022	0.08
251.0057983	0.40
252.2834473	0.06
261.0608826	0.18
262.9986267	0.02
267.0031738	0.16
270.9276733	0.05
273.1366272	0.05
276.9782715	0.08
281.1131287	0.02
287.0950928	3.84
288.2296143	0.07
300.8147583	0.03
302.8475952	0.19
304.8525696	0.04
306.0558167	0.10
309.3538818	0.04
311.0827942	0.30
312.2501221	0.10
317.0751648	2.72
319.1760254	0.11
320.1332397	0.06
321.1634521	0.10
322.9848022	0.26
325.0944214	0.15
326.1178284	0.75
327.2222290	0.45
328.7477417	0.15
332.4973145	0.03
341.2339478	0.49
343.2131958	0.09
345.0339966	0.05
347.0799255	18.29
348.1011658	0.57
357.1446838	0.06
361.1775818	0.66
363.1492310	0.26
370.9218445	0.03
373.1226501	0.07
375.1492615	0.07
377.1470947	0.23
384.2388306	0.15
388.0479431	0.34
389.1781921	1.34
398.3354187	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	658.2
Annotation	Geodiamolide O
Peak:m/z	Relative Intensity
187.3744812	0.10
204.0424957	0.30
217.0532074	0.20
217.8541565	0.16
234.3796387	0.09
236.1991882	0.15
245.0852356	0.30
245.9291229	0.43
247.8964844	0.10
261.0279541	0.42
264.3547363	0.13
272.8732910	0.27
274.1006470	0.39
275.0584717	0.10
276.0670776	0.07
277.1254883	0.22
278.0369873	0.32
284.0538635	1.72
290.0140381	0.24
298.0874023	0.10
303.9041138	0.31
307.0183716	0.41
309.1405029	0.53
315.2503052	1.50
316.0533447	0.88
317.9348145	0.10
320.0681458	0.27
331.9726562	0.17
333.1298218	1.28
337.9886475	0.35
341.2254639	0.06
345.0213623	0.26
346.1278687	0.69
347.7266846	0.61
348.3576660	0.05
350.0471191	0.11
352.9992676	0.19
354.8300781	0.07
362.0640259	0.04
364.7620239	2.74
365.3897095	0.90
366.0736694	0.42
368.0839233	0.26
368.8851929	0.33
379.8505249	1.13
380.4754028	0.06
382.2087402	0.29
384.8841553	0.33
392.5375366	0.13
395.8890381	0.50
396.7895508	0.31
397.9989624	4.91
398.9632568	0.57
404.0317993	0.07
407.0756226	0.14
415.0760498	0.26
416.0799561	2.17
429.0154419	0.27
430.2849121	0.13
444.9794922	0.15
446.2843018	0.60
446.9490967	0.29
447.9015503	1.91
461.0257568	0.13
462.7731934	2.05
463.8677979	1.91
468.7642212	0.12
472.0607910	0.13
474.5229492	0.14
477.8543091	100.00
478.5720215	0.70
479.4876709	0.24
482.3709106	0.16
483.8143311	0.46
486.0328369	0.11
490.1881104	0.22
495.2042236	1.11
495.9819336	5.26
496.9512329	0.23
508.4555054	0.13
522.3883057	0.15
524.3078003	0.05
525.0780029	0.11
526.9620361	4.91
533.4953003	0.18
540.9525757	1.47
549.7791138	0.35
558.7780762	0.04
560.0239258	0.50
577.7066650	0.71
580.2708130	0.10
597.9863281	0.30
599.0668945	0.58
609.8946533	0.49
616.9999390	0.08
638.2309570	0.68
639.9564819	1.26
640.6428833	0.20
641.2620239	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	293.2104
Annotation	13-epi-12-oxo Phytodienoic Acid
Peak:m/z	Relative Intensity
92.81922913	0.21
98.96912384	0.16
101.0105743	0.70
113.0352173	0.54
119.2355957	0.37
123.0863037	0.15
124.7504959	0.41
139.0419769	0.52
143.087616	0.07
146.2218018	0.22
147.3142395	0.09
149.1148376	0.41
151.2861633	0.93
153.2122803	0.17
158.9000092	0.14
163.0805359	0.89
166.9918823	0.22
172.9931946	0.63
175.3064423	0.16
179.0113831	0.70
181.156311	0.32
187.1248169	0.29
189.9756927	0.14
191.0844269	0.45
192.9236755	0.39
193.9776917	0.09
195.0378113	0.15
199.2131042	0.49
201.2060547	0.24
202.9450684	0.17
206.986969	1.16
208.9345398	0.20
211.2492676	0.56
213.1830444	0.29
214.9598694	1.29
215.9205933	0.50
217.3435059	1.36
219.106781	1.13
222.0455627	0.28
223.2259827	0.11
225.183197	0.38
229.3886414	0.61
231.0156555	0.27
233.0971069	0.21
235.2129517	2.11
237.1059875	0.83
239.0991211	1.52
247.3251038	0.28
249.4410095	0.58
251.0333862	0.72
257.2503357	5.33
258.0634155	0.20
264.572937	0.32
265.3940735	0.51
275.2043457	100.00
276.3793335	0.24
292.3670959	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	311.22
Annotation	trans-EKODE-(E)-Ib
Peak:m/z	Relative Intensity
96.56936646	0.33
99.0279007	0.22
110.7575226	0.93
112.85923	0.39
114.0947571	0.44
123.069519	1.27
127.2119751	0.47
131.113739	0.22
133.0951538	1.86
135.2197418	0.42
138.9438477	0.29
143.2375793	0.84
149.1390991	0.47
155.1852722	0.24
157.0302429	0.42
160.8652802	0.48
162.2677612	0.34
166.9758911	0.46
169.1204224	1.56
170.8093719	0.26
177.116333	0.88
178.7637329	1.27
180.9900055	1.31
182.7303314	0.90
183.3425598	0.22
185.0576935	1.00
190.1584167	0.50
192.0753632	0.77
194.516861	0.76
195.2797546	1.19
197.209549	3.02
199.1051941	1.93
203.1484985	0.84
207.0491943	0.32
209.1126404	0.90
210.9881592	5.41
214.9694214	0.28
219.223114	0.86
223.2958069	1.10
224.9116821	0.47
227.0236511	2.19
229.0757141	0.36
233.2862244	0.84
235.0999451	1.25
236.125	0.56
238.3128662	0.38
240.0828857	1.20
241.2510071	1.29
248.1395569	0.16
249.3470459	0.82
251.3651733	1.99
252.1770935	0.91
253.2129517	2.81
254.962738	1.73
257.3592529	0.84
264.8904419	2.06
265.8579102	0.83
267.2832336	1.11
268.1496277	0.66
269.266449	4.47
270.2895508	1.21
271.0559998	0.66
275.2734985	12.40
279.4007263	0.24
281.5475159	0.41
283.2095337	2.10
291.4329834	0.26
293.210144	100.00
294.5791931	0.64
310.9163513	0.64
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	874.069
Annotation	Unknow
Peak:m/z	Relative Intensity
241.4503784	0.13
270.4197388	0.16
316.1397095	0.20
390.3658447	0.06
397.5794067	0.09
399.1212158	0.10
410.5822144	0.06
411.2177124	0.12
429.2006226	0.09
455.5566406	0.07
509.9071655	0.13
526.6662598	0.06
551.4102173	0.12
579.2900391	0.12
632.1716309	0.10
647.9417114	0.11
649.7205200	0.22
652.5396118	0.06
657.3994141	0.17
667.5883179	0.04
678.2523804	0.74
679.3776855	0.06
693.8423462	0.07
702.3374634	0.02
711.5176392	0.12
720.2025146	0.11
731.7295532	8.82
734.1262817	0.14
739.6168823	0.04
753.5258179	0.12
769.2677002	0.59
771.3402710	0.08
776.2106934	0.16
777.3113403	0.06
782.4782715	0.12
804.9503784	0.27
807.7233276	0.15
810.5556030	0.08
824.1267700	0.04
833.4954224	0.48
834.2886353	0.14
837.4530029	0.02
839.2908325	0.11
846.3012085	0.20
852.4332275	0.07
856.6813354	0.26
862.5893555	0.20
882.4374390	0.04
895.6276855	0.09
898.4440308	0.28
899.1586304	0.04
919.2022095	0.25
922.6525269	0.04
923.8453979	0.15
940.5347290	0.05
943.8235474	0.13
956.6173706	0.17
963.3689575	3.93
972.3377075	0.12
987.9873657	0.23
992.6019897	0.19
1012.8483890	1.31
1035.3177490	0.17
1046.1468510	0.04
1047.9912110	0.28
1048.5982670	0.37
1062.5104980	0.10
1066.5961910	0.04
1067.5107420	0.10
1075.7919920	0.10
1095.0944820	0.05
1096.7789310	14.23
1097.7070310	0.40
1099.5247800	0.30
1100.3479000	0.04
1102.7672120	0.19
1147.2060550	0.10
1153.0382080	0.46
1153.7006840	0.59
1168.5401610	0.11
1198.8613280	0.14
1222.7219240	0.14
1249.6831050	0.12
1297.0880130	0.11
1308.3641360	0.12
1309.5256350	0.05
1316.7442630	0.07
1398.9196780	0.10
1410.1339110	0.14
1440.0383300	0.18
1544.6071780	0.06
1551.7935790	0.05
1569.4840090	0.15
1581.7154540	0.06
1620.0324710	0.07
1731.9411620	0.04
1758.4655760	0.05
1859.4694820	0.20
1879.5695800	0.09
1882.1174320	0.04
1891.6141360	5.69
1899.4593510	0.06
1910.9525150	0.04
1917.3909910	0.89
1928.4426270	0.03
1935.3226320	0.21
1936.2403560	0.03
1942.6402590	0.10
1943.9876710	0.05
1954.9753420	1.65
1956.9813230	0.09
1971.4652100	0.32
1975.6802980	0.07
1977.4481200	0.04
1982.2917480	0.30
1988.8980710	0.11
1991.2697750	0.34
1994.9254150	0.04
1996.4022220	100.00
1999.3594970	1.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	399.1213
Annotation	Methyl acrylate-divinylbenzene, completely hydrolyzed, copolymer
Peak:m/z	Relative Intensity
118.2565002	0.44
127.7383041	0.28
130.0248718	9.50
143.9975586	6.27
147.0192261	1.83
158.9723511	0.42
159.9766846	1.44
161.9396362	0.89
177.0321198	4.73
178.2135010	0.62
185.8893738	0.55
186.8794556	0.33
188.1536407	0.28
191.3011932	0.77
199.3037109	0.38
203.1480255	0.18
204.0870056	0.51
205.0752563	6.58
206.0818024	2.18
206.9923401	0.44
211.1715393	0.18
215.1455383	0.29
223.1408081	0.53
227.1921692	0.15
229.1564331	0.91
235.4025574	0.96
237.0089722	100.00
247.0182495	0.50
251.3702087	0.31
253.2545776	0.19
254.2224121	0.19
255.2461548	0.73
257.0902710	0.18
264.9867859	0.31
282.1356812	0.26
284.6541748	0.39
299.3153687	0.51
309.2058716	0.44
320.8658142	0.16
325.9479370	0.29
339.3026733	0.92
340.0704346	0.31
349.2516479	2.05
353.2510681	0.35
354.2328796	0.46
366.3623047	0.95
367.1938782	2.96
368.1192017	0.78
371.1431274	1.50
381.3644714	3.28
382.2761536	2.62
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	683.2658
Annotation	Unknow
Peak:m/z	Relative Intensity
262.3295288	0.08
263.0876465	0.06
331.3966064	0.04
353.1984253	38.41
354.2279053	8.56
367.8465576	0.04
383.2510986	0.02
456.5242920	0.03
460.3500977	0.02
474.1375122	0.03
481.1986694	0.08
518.1652222	100.00
519.2391357	27.63
529.9981689	0.04
535.4235840	0.05
599.8848267	0.06
620.0200806	0.06
638.1951294	0.06
639.3928833	0.04
641.0686646	0.03
684.9396362	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	553.1174
Annotation	Unknow
Peak:m/z	Relative Intensity
181.9463654	0.66
197.5538025	0.22
222.0948792	0.27
292.5137329	0.30
310.8560791	3.39
317.8661499	0.17
326.0895386	0.24
329.1447754	0.24
329.8864746	0.13
331.0556641	0.17
343.8784790	5.39
344.5129395	0.10
346.8430786	0.12
358.6891479	0.14
373.0046997	0.45
390.7984619	5.76
405.9089355	0.38
416.7812500	0.22
418.5969849	0.56
420.2174683	0.08
422.1184082	0.53
423.2971802	2.82
424.1187134	3.43
429.2017212	0.37
431.2235107	0.21
433.5187988	0.91
435.1302490	3.89
436.0368042	1.60
437.0097046	0.50
438.9136963	0.22
439.9396973	0.10
441.0421753	0.20
447.0289917	0.04
455.0300293	1.13
462.8108521	0.08
470.7318726	0.18
472.9334717	100.00
473.6011353	0.60
474.7874146	0.18
488.3918457	0.39
490.3004761	0.28
498.6568604	0.14
509.3172607	0.11
522.5486450	0.15
525.9699097	0.15
534.1699829	0.29
534.8700562	0.27
542.6788940	0.11
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
147.2322845	0.07
159.2073669	0.04
188.0955963	100.00
188.8365326	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	487.2546
Annotation	alpha-Ionol O-[arabinosyl-(1->6)-glucoside]
Peak:m/z	Relative Intensity
151.0091553	0.07
156.9915924	0.03
159.0628204	0.06
160.9310760	0.13
167.3385468	0.08
177.1695862	0.69
178.8417816	0.14
181.1678162	0.06
184.7542114	0.07
189.1279449	0.12
191.0513306	0.07
193.3531494	0.11
194.9879761	0.37
197.1134949	0.10
201.2013092	0.09
204.9846191	0.07
207.0775146	0.38
211.1130981	0.98
212.3019104	0.43
213.3828278	0.60
217.3300171	0.10
219.2446594	0.36
221.2337189	0.23
222.2468567	0.06
227.2401276	0.08
231.3013000	0.15
233.1869659	0.16
235.2581482	0.08
239.1291199	2.15
240.0879211	1.78
241.2436218	1.71
243.2409515	0.12
245.2727051	0.31
246.2094116	0.05
247.2841949	0.40
249.1159363	0.33
259.3677063	0.24
261.3322449	0.17
263.1337585	0.21
264.9990234	0.04
271.1479797	0.04
273.2871094	0.34
279.2771606	0.32
281.3263855	0.04
283.3029785	0.05
287.2305603	0.26
289.2457275	0.57
291.3490601	0.08
293.2717896	0.10
294.4712830	0.05
295.4743652	0.05
303.2063599	0.24
307.3336182	10.74
308.1913452	0.09
309.3196716	0.35
313.2221680	0.07
313.8801575	0.06
315.4045105	0.05
319.3641357	0.11
321.2890625	2.49
323.7434082	0.16
325.2733765	100.00
326.2760620	1.27
329.3230896	0.04
332.2095337	0.14
333.0788574	0.25
333.6956787	0.29
337.2987061	0.04
343.3066406	0.19
346.5088196	0.04
349.1478882	0.45
357.4463501	0.04
359.2628784	1.14
360.4599609	0.04
367.3760071	1.94
368.5012817	0.04
371.4550781	0.18
373.3674622	1.91
374.5049744	0.62
379.2565308	1.27
380.2633362	0.15
384.3238220	0.06
390.9394836	0.21
396.1876831	0.06
397.1628723	0.04
399.4884949	0.10
401.5508423	2.49
402.2420349	8.78
405.5247803	0.05
421.1797180	0.09
423.1620789	0.12
424.2312927	0.06
425.5553894	0.12
426.1852112	0.10
427.4291687	0.04
436.1441956	0.06
440.5404053	0.07
442.9828796	1.05
447.9076538	0.15
451.2251282	0.29
451.8792419	0.07
459.0091248	0.06
467.2246704	0.29
468.0990906	0.26
469.3497009	4.05
470.5072632	0.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	504.1909
Annotation	Unknow
Peak:m/z	Relative Intensity
144.0722656	13.23
161.9731750	100.00
179.7326813	0.71
252.1812592	0.56
252.8140259	0.79
258.9129944	0.73
271.2081909	0.41
288.4045410	0.99
289.0639954	1.31
324.1998901	0.61
325.0324097	13.55
450.2295227	2.39
486.7277527	4.89
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	680.93
Annotation	Unknow
Peak:m/z	Relative Intensity
177.3880310	0.22
212.8611145	0.17
232.1844177	0.13
251.0748291	0.47
253.2585754	0.15
288.8955078	2.19
291.1334534	0.23
293.0198364	0.55
301.0545349	0.15
316.9725952	0.34
319.0869751	9.23
324.2924194	0.17
332.9487915	2.05
339.1629333	0.37
340.2382507	0.13
358.2412109	1.78
362.2750854	0.44
368.8583984	0.21
370.8004150	0.88
380.8171997	0.23
383.0842896	9.86
401.0498657	22.96
406.8992310	2.22
419.0423584	0.33
420.9937744	2.02
426.8092041	0.33
428.8320923	0.43
436.9722290	24.17
438.9954834	7.44
450.6480103	0.76
455.0718384	2.29
492.8746338	0.33
498.2588501	0.20
501.0911865	5.83
503.2165527	0.64
506.7292480	86.26
507.3458862	0.48
510.3078003	0.27
510.9082642	0.93
512.2065430	0.40
512.8582764	1.16
516.5616455	1.22
517.5149536	0.51
518.8856201	100.00
519.5715942	1.11
524.5596313	2.47
525.6973877	1.17
528.5409546	0.60
529.2022095	0.99
531.0072632	0.96
544.6527710	22.92
545.3073120	1.56
549.0583496	0.08
551.2669067	0.14
554.8569336	0.16
557.9558716	0.17
560.1411743	1.17
561.1182251	0.45
568.9688721	14.21
569.5950317	0.08
581.9574585	0.19
588.9004517	0.33
594.8966675	1.58
596.6539917	39.74
597.4508057	1.26
599.2604980	1.26
602.4957886	1.02
612.0759888	0.96
612.7385864	8.49
614.2645264	0.69
615.4518433	0.48
616.4846802	1.24
633.8242798	1.54
635.1735840	0.77
637.0464478	0.34
638.0958252	12.24
638.9827271	0.26
639.6111450	0.48
657.2844238	5.18
658.1914673	3.04
659.9641724	0.48
662.9147949	2.91
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	564.1929
Annotation	Unknow
Peak:m/z	Relative Intensity
181.2532806	0.08
193.0149841	0.05
218.2474670	0.26
221.1750183	0.11
224.0987396	0.05
225.2225189	0.47
315.1022339	0.04
317.3815308	0.03
321.2207031	0.05
353.2367554	10.61
380.2742920	0.08
386.2028809	0.16
399.1742554	18.93
400.2461548	0.10
428.0791016	0.03
436.3319702	0.03
451.2582397	0.04
463.2750244	0.11
479.9483643	0.06
497.8514404	0.03
500.2390747	0.29
502.1566772	0.07
503.3154907	0.04
518.0918579	100.00
518.8079224	0.30
519.8480835	0.14
528.2664185	0.08
545.3960571	0.13
546.2545776	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	299.2596
Annotation	DL-2-hydroxy stearic acid
Peak:m/z	Relative Intensity
96.93669891	0.37
111.0188599	0.08
119.0439987	0.20
136.9637756	0.06
139.1752319	0.20
141.0553284	0.12
159.1421509	0.30
173.1744995	0.49
183.1421051	0.35
185.0154724	0.61
185.940979	0.22
187.1066589	0.51
193.296875	0.16
197.466568	0.09
199.2586975	0.35
201.0774841	0.20
205.1557922	0.20
211.04422	0.33
214.2608032	0.10
215.1424866	0.24
219.1671143	0.21
225.1803894	0.06
227.2619019	0.42
237.2807617	0.70
239.0869141	0.28
241.2994385	0.08
243.5292969	0.08
251.3616638	0.44
253.25354	100.00
254.3554382	2.55
255.2550049	2.65
256.2538452	0.26
256.9973145	0.10
263.3423157	0.55
267.2345886	0.18
271.0777588	0.25
273.038269	0.22
280.3145142	0.41
281.2390747	8.83
282.0143127	0.90
283.0643311	5.88
283.9332275	0.61
289.0701294	0.05
298.9762878	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	448.1928
Annotation	Unknow
Peak:m/z	Relative Intensity
132.0790253	0.13
133.0936127	0.13
133.8948517	0.10
149.2285767	0.04
151.2328796	0.04
159.9007416	0.03
168.3183594	0.06
169.0299377	0.11
178.1297913	0.04
182.2268066	0.10
187.2802429	0.05
202.1198120	0.63
203.5112457	0.02
206.2465820	0.04
216.2155151	0.82
217.0570984	0.16
230.1730804	0.75
231.2939911	0.07
233.2622070	0.42
234.1059723	0.05
242.1009216	0.16
243.1069641	0.06
245.1816406	0.10
248.4147949	0.05
257.2350159	0.08
259.1744995	100.00
260.1722412	17.71
260.7773438	0.06
275.2999268	0.66
277.1732178	10.66
278.3529053	1.59
279.2470398	0.04
284.1710205	55.02
285.1516724	10.28
286.1730957	0.06
287.1164551	1.17
301.1918640	81.35
302.1695862	25.14
303.1387024	2.51
304.6441040	0.09
309.9303589	0.02
312.2489929	0.06
317.1015930	0.05
319.1749268	38.05
320.2421265	7.15
320.9279175	0.01
325.3590088	0.03
334.1380310	0.03
342.3276367	0.06
345.5264282	0.05
346.2849121	0.09
348.8101807	0.17
360.4804077	0.13
363.1852112	2.79
364.2756042	0.29
367.0242615	0.17
368.5900574	0.16
370.3283081	0.10
380.7823181	0.05
383.2320862	0.05
384.0369873	0.12
385.0804443	3.91
386.2768860	1.01
388.2114258	12.49
389.2818909	2.69
393.0287170	0.10
395.2205505	0.45
395.9343567	0.08
401.1696472	0.07
402.3049622	6.86
403.4139099	1.72
404.4299622	1.08
406.2066956	72.11
407.3276978	15.03
413.1087341	9.42
414.2799072	2.63
430.2455139	70.74
431.2497253	37.66
432.2846375	4.56
438.5195923	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	309.207
Annotation	9(S)-HpOTrE
Peak:m/z	Relative Intensity
97.03208923	1.72
100.8403625	0.26
111.09021	0.38
125.1030045	0.74
135.122406	0.63
153.1441956	1.08
155.2042236	0.27
165.1150513	0.90
177.1733856	0.91
179.1657867	0.73
183.2894897	0.49
189.158783	0.91
193.1621094	0.22
195.1045074	3.18
197.5402069	0.27
201.4578094	0.29
205.0538025	1.00
207.2644653	0.65
209.0715332	0.73
211.2444763	0.26
215.1344604	0.51
217.3171082	0.78
221.2049561	12.62
223.1253967	2.75
225.1387939	1.07
229.2460327	0.28
231.2473755	0.39
233.1512146	2.75
235.2608948	0.27
237.2037964	0.75
238.3382263	0.20
239.2183228	5.45
241.3776855	0.54
244.9836426	1.01
247.2626648	2.73
249.2108154	0.27
250.3012695	0.16
251.2130127	3.71
253.2929688	1.04
263.1328735	1.98
265.2645569	4.03
266.8813782	1.72
267.5388184	0.97
271.9328003	0.63
273.1715088	4.75
281.4059448	6.05
289.2178955	1.94
291.2024231	100.00
292.0099487	0.12
292.8822632	0.37
312.1039429	0.51
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	977.27
Annotation	Unknow
Peak:m/z	Relative Intensity
300.3163147	0.04
303.2932129	0.05
314.1909790	0.04
315.0276184	0.05
320.3961792	0.20
343.1132812	0.16
346.3076782	0.11
368.2714844	0.08
395.4044495	0.12
397.3988953	0.08
407.2583923	0.16
418.1602173	0.13
420.9335938	0.07
425.1657715	0.24
435.2349854	0.10
446.6254883	0.06
463.4094238	0.11
469.2961426	0.04
474.1362305	0.14
494.4366455	0.19
504.0974121	0.12
543.4708252	0.18
548.3228149	0.04
574.4022217	0.12
604.8574829	0.09
614.3762817	0.17
619.9169312	0.35
632.5363159	0.10
657.5641479	0.06
668.9130249	0.10
676.4861450	0.17
681.2054443	0.13
694.2774658	0.05
700.4364014	0.12
739.4162598	0.17
746.5349731	0.03
747.1970825	0.04
748.7616577	0.14
752.9041138	0.07
762.4271851	0.03
771.5840454	0.08
805.7868042	0.13
819.4056396	0.25
820.6853638	0.04
832.7516479	0.05
845.0432129	0.06
863.0207520	0.15
881.4171753	0.18
909.6184692	0.13
910.4776001	0.19
913.1347046	0.06
918.8942261	0.14
919.6991577	0.16
923.7662964	1.66
924.6989136	0.23
928.3912354	0.08
929.7422485	0.28
931.5072632	0.04
934.2332153	0.12
935.3491821	0.52
936.6798096	0.76
937.4616089	0.34
939.5280762	0.40
940.2022095	0.55
941.1884155	0.28
942.0042114	0.03
942.6543579	1.73
943.5441895	2.03
944.9257812	7.07
945.8572388	0.37
946.6729126	0.93
948.6389771	2.48
949.4650269	0.36
951.0343628	1.86
951.9492188	1.59
952.6303101	0.50
953.7273560	8.72
954.4470215	0.59
955.6740112	1.05
956.3896484	20.25
957.7139282	1.76
958.6635132	3.18
959.4786987	2.18
960.3635254	0.10
961.7293091	1.10
962.6521606	1.45
963.7277832	1.57
964.7581177	6.77
965.5029907	1.11
966.9374390	0.21
967.5410156	0.08
968.2498169	0.04
970.3233032	0.17
971.8262329	0.06
986.7462769	0.31
1004.4100950	0.31
1005.0249630	0.25
1006.6058960	0.05
1007.9585570	0.46
1008.8590700	0.34
1010.5407710	0.25
1012.1015620	0.90
1014.2080690	0.69
1015.2345580	0.13
1021.6245730	0.40
1024.3082280	0.61
1027.6086430	0.10
1031.2348630	0.08
1034.7138670	0.58
1036.2137450	0.18
1036.9442140	0.03
1037.5600590	0.05
1039.1584470	0.55
1041.6331790	2.47
1042.9331050	0.88
1043.9565430	0.48
1049.0336910	0.44
1051.7872310	0.45
1052.8588870	0.39
1054.1467290	0.61
1054.8039550	0.04
1055.8828120	0.87
1056.7034910	0.57
1057.6710210	0.08
1058.5964360	2.68
1059.5869140	1.05
1060.4780270	2.81
1061.3659670	0.40
1062.8798830	2.88
1063.8444820	0.51
1064.4455570	0.26
1066.1345210	6.85
1067.0187990	0.98
1068.0241700	0.22
1069.5065920	1.53
1070.3830570	0.77
1071.5432130	0.80
1072.2045900	1.12
1073.3845210	1.24
1074.8012700	2.47
1075.7492680	0.84
1076.8385010	1.13
1077.7669680	8.67
1078.4986570	1.37
1079.9315190	2.98
1080.8776860	2.83
1081.8702390	1.78
1082.4904790	0.32
1084.1777340	1.96
1085.1752930	4.62
1086.5194090	1.71
1087.4774170	3.47
1089.2653810	1.28
1090.4804690	4.29
1091.2995610	2.87
1093.1757810	0.65
1093.7836910	2.66
1094.6292720	2.04
1096.1036380	4.02
1096.9311520	0.71
1098.7432860	9.22
1099.4542240	4.57
1100.2924800	2.04
1101.1494140	6.86
1101.9372560	16.90
1102.8760990	3.63
1104.4381100	6.14
1105.6857910	2.21
1106.3831790	1.87
1107.3645020	1.85
1108.1240230	1.83
1109.2585450	8.39
1110.1479490	1.90
1110.8959960	0.52
1112.4494630	26.19
1113.3724370	1.87
1114.7602540	2.13
1115.4660640	100.00
1116.7641600	3.49
1118.3920900	23.83
1119.8425290	0.19
1121.0848390	1.83
1121.9868160	0.24
1122.7641600	2.07
1123.6772460	0.57
1124.9621580	3.59
1126.2966310	0.85
1127.2127690	0.10
1128.0917970	0.98
1129.2301030	0.29
1131.1574710	1.63
1133.9370120	6.96
1134.6933590	1.44
1135.3520510	0.09
1136.5712890	9.17
1137.3005370	6.12
1138.2974850	0.35
1139.2185060	0.04
1140.4754640	0.48
1145.4655760	0.42
1147.6448970	0.04
1153.9804690	0.56
1156.8750000	0.16
1164.0585940	0.32
1171.3725590	0.53
1173.7858890	0.55
1175.3878170	1.24
1176.7753910	1.32
1178.5388180	0.04
1179.4965820	0.54
1180.6055910	1.69
1183.3006590	0.11
1184.5219730	0.39
1187.7622070	0.45
1189.7148440	0.36
1191.7136230	0.72
1195.2871090	1.04
1196.2456050	0.82
1198.8972170	0.35
1200.7181400	0.92
1204.4432370	0.70
1207.1871340	1.07
1210.0604250	0.95
1210.9409180	1.01
1212.1518550	0.87
1213.3763430	0.80
1214.3083500	0.12
1215.4687500	0.07
1216.9919430	0.04
1219.0095210	0.47
1220.1439210	0.13
1221.3253170	1.47
1222.9974370	1.48
1224.2565920	0.67
1225.1762700	0.35
1226.7995610	0.29
1228.5727540	1.31
1229.7468260	0.49
1231.0625000	0.36
1232.9145510	0.27
1234.1365970	0.70
1234.8010250	0.35
1235.5573730	1.50
1236.3612060	1.26
1237.1142580	0.56
1239.2117920	0.43
1240.1407470	1.48
1241.3109130	1.70
1243.2366940	1.19
1243.9047850	0.63
1245.7333980	0.78
1246.7197270	0.46
1247.4442140	0.23
1249.5716550	1.79
1250.2698970	0.97
1251.1832280	0.61
1253.2584230	0.78
1253.9349370	0.50
1255.1599120	0.64
1255.9481200	0.27
1257.2518310	0.66
1258.2766110	2.04
1259.0166020	1.67
1260.2792970	1.43
1261.6976320	1.79
1262.7164310	0.81
1263.5632320	0.65
1265.6478270	2.93
1266.4184570	1.96
1268.3791500	0.41
1269.5632320	1.54
1270.2929690	0.68
1271.7221680	1.16
1272.6313480	0.63
1274.7692870	1.22
1275.8098140	2.26
1276.8834230	0.51
1278.3486330	4.44
1279.5493160	1.53
1280.2493900	0.66
1281.4173580	0.64
1282.5975340	1.71
1283.5191650	0.72
1284.4816890	0.42
1285.7384030	1.45
1286.7324220	1.53
1287.5454100	0.96
1288.4465330	1.11
1289.8566890	1.82
1290.7696530	0.47
1291.4022220	0.77
1292.6468510	3.41
1293.5439450	1.35
1294.6983640	0.52
1295.6040040	2.79
1296.5479740	2.23
1297.6550290	2.27
1298.5067140	0.78
1299.5693360	1.23
1300.9713130	0.52
1301.7064210	2.38
1302.4522710	0.95
1304.0030520	0.70
1304.7364500	0.61
1305.4901120	0.43
1306.6949460	0.65
1307.7590330	0.80
1308.6678470	0.86
1310.2705080	0.44
1311.9516600	0.99
1312.7442630	1.18
1314.6745610	0.85
1315.3546140	1.77
1316.4249270	0.74
1317.9124760	0.90
1318.5867920	0.95
1319.4039310	0.27
1321.3096920	2.16
1323.9298100	0.52
1324.6999510	0.35
1325.8192140	0.13
1326.8497310	0.46
1327.5612790	0.24
1328.2086180	0.22
1329.9830320	0.45
1334.6856690	0.19
1338.0616460	0.20
1338.7261960	0.33
1339.6179200	0.10
1340.2752690	0.40
1341.1063230	0.03
1343.7120360	0.43
1344.4453120	0.44
1345.4947510	1.78
1348.4720460	0.45
1350.6462400	0.20
1351.3026120	0.19
1352.0860600	0.25
1353.5627440	0.46
1356.9561770	0.63
1357.8156740	0.93
1361.7397460	0.28
1363.1699220	0.18
1365.9771730	0.28
1373.2926030	0.46
1377.0335690	0.37
1385.5889890	0.38
1389.8587650	0.69
1390.6612550	0.16
1394.9537350	0.53
1398.7042240	0.19
1399.6816410	0.06
1402.9656980	0.30
1404.5705570	0.15
1410.8139650	0.62
1412.3206790	0.69
1416.5828860	0.37
1430.2221680	0.59
1434.4884030	0.33
1437.6796880	0.12
1438.6220700	0.66
1443.2078860	0.26
1444.2830810	0.78
1447.4348140	0.53
1457.4127200	0.30
1463.4896240	0.17
1469.9754640	0.15
1474.2392580	0.49
1475.3164060	0.24
1478.9416500	0.22
1480.2382810	0.55
1483.9237060	0.55
1485.7174070	0.55
1488.5671390	0.25
1493.7796630	0.10
1504.2664790	0.42
1505.1102290	0.05
1506.9739990	0.58
1508.2938230	0.34
1509.3842770	0.67
1514.4859620	0.74
1517.1949460	0.23
1520.3116460	0.35
1522.7501220	0.61
1524.2603760	0.13
1525.9364010	0.45
1533.7752690	0.16
1539.7323000	0.28
1545.0841060	0.12
1549.6951900	0.07
1550.3195800	0.45
1551.5217290	0.31
1553.6879880	0.31
1554.5920410	0.30
1561.8341060	0.04
1562.7237550	0.07
1564.4379880	0.46
1570.4178470	0.37
1581.9333500	0.08
1583.5247800	0.46
1586.9105220	0.29
1596.1907960	0.35
1599.8836670	0.95
1612.8843990	0.14
1621.0811770	0.40
1623.2222900	0.07
1625.1965330	0.26
1643.0979000	0.21
1650.7399900	0.10
1654.6447750	0.18
1660.8924560	0.25
1680.0749510	0.03
1696.5432130	0.15
1705.2244870	0.09
1721.3244630	0.17
1743.0040280	0.08
1746.3455810	0.04
1786.4293210	0.44
1796.9006350	0.18
1804.5418700	0.24
1835.8381350	0.24
1837.7779540	0.34
1843.2457280	0.12
1843.9530030	0.06
1854.0046390	0.09
1859.3088380	0.17
1862.7628170	0.28
1866.6739500	0.39
1894.1170650	0.08
1902.0257570	0.04
1910.6320800	0.45
1911.3322750	0.54
1918.8773190	0.03
1920.7932130	0.42
1932.1623540	0.29
1933.5686040	0.03
1934.8973390	0.17
1937.2532960	0.03
1944.6771240	0.10
1949.0860600	12.08
1949.9422610	0.31
1951.1671140	2.31
1952.6949460	0.08
1957.5941160	0.33
1958.3792720	0.04
1959.9903560	0.05
1960.7894290	0.08
1965.3607180	0.58
1969.6042480	0.02
1975.3399660	0.15
1980.3620610	0.09
1983.4439700	0.03
1985.1511230	0.09
1987.7764890	0.30
1991.1667480	0.66
1994.6148680	0.47
1995.3742680	0.13
1996.0050050	1.39
1998.1485600	0.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	361.1866
Annotation	Unknow
Peak:m/z	Relative Intensity
107.5383682	0.05
111.0018234	0.22
112.9791565	0.55
114.8756180	0.04
118.9766998	0.23
119.8780746	0.02
124.3218307	0.23
125.0772781	0.91
125.8619156	0.12
129.0724182	0.08
131.0119019	0.03
137.1767578	0.02
138.3115387	0.01
139.2950134	0.01
141.0730133	0.15
142.3337708	0.06
143.0495300	0.44
144.1384277	0.03
147.2621002	0.01
149.1639709	0.02
149.9802856	0.03
151.2696533	0.03
153.1750488	1.61
154.2227936	0.11
155.1534424	0.10
156.0526428	0.03
157.1242065	0.01
159.0072937	0.05
160.3858337	0.03
161.1435852	0.10
163.1952820	0.09
165.3297729	0.03
167.2644653	0.05
169.4276123	0.03
175.0861206	0.05
177.0205078	0.04
177.6282349	0.01
179.0885315	0.13
181.1036987	1.14
182.1177063	0.11
183.0919189	0.18
184.1215820	0.08
185.2284546	0.87
186.2196808	0.09
187.2591095	0.01
189.3114777	0.02
191.0773926	0.09
192.4208374	0.02
193.3212891	0.10
195.2388000	0.22
197.0823364	0.24
199.1636505	61.87
200.1402588	7.44
201.3064270	0.02
203.2015381	0.04
205.0453796	0.08
207.0601501	0.44
208.0799408	0.05
209.3439026	0.07
211.1793365	0.53
212.4045410	0.21
213.2092590	1.25
214.2538452	0.21
217.2612915	0.05
219.2531433	0.02
220.5694275	0.03
221.2496948	0.17
222.1204529	0.05
223.0835876	0.45
224.1913147	0.12
225.1563416	0.85
226.2290039	0.04
231.0921021	0.07
232.1612549	0.04
233.3172607	0.11
235.1833496	0.81
236.1704102	0.20
237.2023621	0.11
238.6676941	0.08
239.3152466	0.20
240.1864624	0.05
241.2409058	1.54
242.3351135	0.19
245.1980896	0.08
248.0198669	0.02
249.5019226	0.19
250.2660522	0.04
251.3132324	0.14
253.1252441	0.82
254.2545166	0.16
255.3149414	0.23
256.2715759	0.07
257.3812561	0.02
259.2631531	0.09
261.2209167	0.14
262.1388855	0.02
263.2412109	0.23
264.5458069	0.07
265.2659912	0.36
266.2673950	0.03
267.2850037	0.06
269.4127197	0.06
270.3098145	0.02
271.3321533	0.02
273.2902832	0.06
277.2702637	0.28
278.3945923	0.11
279.5986023	0.10
280.2115479	0.01
281.2889709	0.23
283.3065186	0.58
284.2831421	0.08
289.2410889	0.08
290.1730652	0.02
295.2221375	0.20
296.1702576	0.07
297.5574951	0.02
298.1912842	0.01
299.3534546	0.30
301.0415955	0.02
305.2295837	0.01
307.2882080	0.23
313.1368408	0.36
314.2262268	0.11
315.2440796	0.21
316.2584229	0.03
317.3528442	0.04
318.2165527	0.05
319.0085144	0.04
324.0408630	0.07
325.2493896	2.54
326.3322144	0.71
330.0772705	0.01
331.2427368	0.04
333.7740784	0.01
341.3652649	0.01
343.2242737	100.00
344.2168884	18.94
344.8827209	0.09
345.6346741	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	273.96
Annotation	Unknow
Peak:m/z	Relative Intensity
114.9720306	5.65
116.0460815	1.18
131.0313110	0.26
132.1734009	0.04
158.9398804	100.00
159.9244385	26.74
198.9836426	1.59
200.0058289	1.02
200.9183350	0.03
201.8457642	0.01
216.9726257	0.60
218.0216370	0.55
223.9718323	0.01
228.9086304	20.63
229.9116821	12.11
230.5118103	0.03
231.2217102	0.01
244.9888306	0.28
246.0252991	0.20
247.0878296	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	395.1095
Annotation	Unknow
Peak:m/z	Relative Intensity
144.9631042	0.66
146.0190430	0.66
147.0515442	4.26
155.0835571	0.20
162.9806671	11.78
180.0443115	0.09
185.3725281	0.06
188.0671387	0.05
189.0468903	0.51
190.9898682	100.00
193.4077148	0.03
204.9962311	0.14
209.2756042	0.16
226.2027588	0.04
227.3147888	0.21
233.0897827	0.11
245.0969849	0.14
248.0175781	0.06
258.4693909	0.04
264.8828430	0.05
267.2773132	0.12
272.6395874	0.12
273.2534790	0.08
293.8228149	0.08
297.2560425	0.06
298.8229065	0.04
299.4761353	0.24
309.1363525	0.09
313.4478760	0.11
314.0692139	0.20
315.3057251	0.58
330.9999390	0.09
333.2322998	0.19
335.1511230	1.83
337.0900269	0.31
345.0692749	0.05
349.1119995	0.73
351.3306274	0.23
353.1598816	2.04
356.9478149	0.29
358.9490356	0.33
365.1050110	0.10
377.2187195	0.49
379.0854187	0.07
385.1662903	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	218.1033
Annotation	Pantothenic acid
Peak:m/z	Relative Intensity
70.9524078	1.26
71.8357391	0.04
87.9017944	100.00
92.8931122	0.10
146.0424042	13.63
199.2031403	0.04
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
93.0060883	1.37
100.7285080	0.02
113.9779816	0.03
125.0646057	0.03
127.9525528	0.04
136.9254761	100.00
137.7875366	0.06
145.0361328	0.03
158.9609070	0.05
160.9796906	0.19
177.0154572	0.02
180.9477539	0.03
203.2044067	0.05
231.0890808	0.04
252.8911133	0.06
254.7028503	0.03
255.3388062	0.02
256.9709473	0.07
279.8860168	0.05
281.1535034	0.41
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	374.1071
Annotation	DIMBOA-Glc
Peak:m/z	Relative Intensity
118.9217377	0.76
129.0238647	1.24
130.1860046	0.25
136.0122986	4.34
146.7104797	0.98
147.9758453	0.66
165.0566711	13.07
174.8322754	0.43
181.9727173	100.00
186.6385651	0.15
198.0524750	0.61
199.2242889	0.46
204.5678711	0.26
226.1418457	1.48
227.0107422	0.66
244.2948914	0.32
258.1831055	0.53
260.2840271	0.68
279.0843506	0.74
300.2154541	0.43
302.3262329	0.44
310.2126465	46.06
311.8182373	0.21
323.9391174	0.23
328.1969299	0.19
335.6675415	0.34
338.3469849	2.42
339.0404053	0.18
350.6873474	1.37
355.2789612	2.20
356.3071594	8.39
357.1414795	0.95
364.8834839	1.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	474.2623
Annotation	LysoPE(0:0/18:3(9Z,12Z,15Z))
Peak:m/z	Relative Intensity
140.0360718	0.08
152.9563446	0.05
196.1030273	2.47
203.1516418	0.03
214.1704102	1.56
221.3335266	0.04
222.1326904	0.02
231.0497437	0.03
233.3216400	0.75
235.3713226	0.02
238.4220276	0.05
253.5879822	0.05
257.3287354	0.02
259.2645264	0.31
261.4447021	0.07
275.3930969	0.56
277.2753296	100.00
278.0871582	0.01
305.2805176	0.03
312.4013062	0.04
352.2994385	0.04
369.3187866	0.02
370.3096008	0.02
375.0324402	0.05
384.1618347	0.10
402.1284485	0.03
411.5079956	0.02
413.2225037	0.28
426.9913635	0.02
430.1937561	0.15
431.1816101	0.15
438.4492493	0.10
455.3842773	0.03
456.3961792	0.04
459.5999756	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	857.2414
Annotation	Unknow
Peak:m/z	Relative Intensity
249.3483887	0.07
271.3662720	0.07
282.2196350	0.10
334.1490479	1.07
336.3663635	0.54
351.2610474	1.25
362.1845703	0.23
368.9561157	18.08
390.1255493	0.09
392.8138123	0.08
407.5073853	0.67
408.7486572	1.52
410.0238037	0.67
410.9159546	4.91
448.8374023	0.22
490.6554565	2.57
498.5487671	0.47
525.4636230	0.16
539.6806030	0.51
554.4036865	0.09
566.5399780	0.37
568.9979858	0.08
570.7677002	0.30
572.9458008	100.00
580.2409058	0.08
591.0435181	0.24
620.4979248	0.15
626.8570557	0.12
652.2146606	2.95
652.9049683	15.47
656.0733032	0.23
662.4961548	0.07
709.3613281	0.16
710.3518677	0.14
711.4139404	0.19
728.6701050	0.04
772.5034790	0.09
775.6860962	0.37
776.7222900	0.24
778.4950562	0.07
779.9216309	0.39
796.9573975	0.57
813.2904663	0.25
838.3710327	0.07
839.4639893	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	656.2047
Annotation	Unknow
Peak:m/z	Relative Intensity
229.2634430	2.95
269.3480530	1.09
313.1250610	5.86
313.8967896	17.30
324.2658691	0.87
324.9340820	30.17
327.1432190	2.92
331.4721680	5.72
332.1615295	2.21
342.8278198	7.01
458.2615967	1.23
472.8229370	1.83
475.8040771	39.05
476.4807129	0.96
486.5360718	0.71
493.8975220	100.00
494.5139160	0.86
504.6315308	0.82
620.2142334	2.06
637.8279419	14.87
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
204.2570801	0.04
206.7455902	0.16
290.7861938	6.28
296.5690308	0.09
314.8560181	0.07
316.1236572	0.11
321.0167847	0.04
334.6708374	0.02
338.8178711	0.53
356.9246216	0.06
367.1814575	0.05
369.0773315	0.34
374.7935181	6.84
376.8986206	0.26
379.2007446	1.04
380.0975952	1.74
380.8651733	1.05
386.8595581	0.02
391.1724854	0.17
398.9031982	1.57
405.6170044	0.02
406.6019287	0.58
407.2116089	0.03
412.9299927	0.30
422.7564087	3.66
436.7022705	5.41
452.7312012	1.17
458.6116943	100.00
459.4313354	0.12
466.2686768	0.13
466.8886108	0.06
474.0122681	0.48
474.8832397	0.03
478.7431030	2.87
482.7363892	13.93
483.3390503	0.06
496.0852661	1.31
496.8596802	4.40
512.8262329	0.31
524.0464478	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	309.16
Annotation	1-[(5-Amino-5-carboxypentyl)amino]-1-deoxyfructose
Peak:m/z	Relative Intensity
83.0496674	0.13
116.2960052	0.10
128.1074677	0.08
129.9266663	0.10
143.3433228	0.15
147.0615540	1.23
163.9774780	0.24
181.0494995	0.69
187.1883392	0.20
188.2898560	0.26
193.1000977	0.09
213.1902161	0.22
225.1837158	8.91
227.1396484	0.14
237.2986450	0.14
248.9877930	0.24
253.0070801	0.08
256.4229736	0.84
262.6476440	0.71
263.3143921	0.35
265.2182007	0.28
267.8513794	4.29
273.0842590	18.50
278.4017334	1.04
284.7398071	0.80
285.7892761	1.12
286.8792419	0.54
288.4269409	0.28
291.1559143	100.00
292.0427246	0.47
295.5173340	0.25
297.2780151	0.14
300.0697327	1.84
300.9384460	0.91
301.9866638	0.33
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	512.1259
Annotation	Unknow
Peak:m/z	Relative Intensity
146.0339813	0.05
163.0317230	0.42
169.8700562	0.06
178.8781433	0.19
179.8657074	0.12
180.8058929	0.10
191.1524506	0.12
192.7800293	0.06
199.1777039	0.06
204.0520630	0.07
209.2602081	0.14
210.8426514	0.11
215.2135773	0.08
220.9702454	4.68
226.2641754	0.15
236.1535187	0.35
237.9885712	5.91
249.3953247	0.14
253.7827759	0.28
262.0516968	0.07
274.1702881	0.31
279.0728149	0.15
280.2697144	0.09
291.8095093	0.37
308.2759399	0.38
316.3026733	0.06
329.3943481	0.31
330.6843872	0.22
333.2413940	0.59
336.4213257	0.13
337.3237305	0.12
340.3697510	0.08
341.2318726	0.06
345.4388428	0.12
348.2679443	0.16
353.1566772	0.11
365.2229004	0.59
367.0999756	100.00
373.1697998	0.10
379.3638916	0.11
380.9687500	0.18
383.0172729	9.13
394.0435181	0.16
395.9381714	0.10
399.1618042	0.18
414.1244507	0.05
420.9343872	0.07
430.0979004	0.13
432.4260254	0.49
437.2407837	1.38
439.0722656	0.09
439.7929688	0.18
446.8027344	0.07
451.6889038	0.25
457.7948608	0.18
458.6140137	0.11
465.7299194	0.08
466.4291382	0.12
475.2467651	0.11
476.3893433	0.08
477.3040161	0.12
479.2864380	0.44
480.3139038	0.05
489.4039917	0.18
493.2615356	1.02
494.1677246	1.27
495.6078491	0.07
502.5992432	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	280.0826
Annotation	4-Hydroxyphenylacetylglutamine
Peak:m/z	Relative Intensity
96.9715805	0.04
111.1396637	0.02
147.3398438	0.02
148.7371826	0.05
164.0867310	5.08
183.9488373	0.01
187.2502747	0.05
195.6176147	0.02
199.4169922	0.02
202.2011719	0.02
203.1081848	0.04
205.0681152	0.07
218.2314758	0.12
219.1842041	0.04
220.1243591	0.07
223.5779419	0.02
233.1621399	0.04
234.0904846	0.05
235.2640076	0.26
235.9533691	0.07
237.1884155	0.04
244.0769043	12.03
244.8498840	0.01
259.2307739	0.01
260.2933350	0.04
262.0595398	100.00
264.1419678	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1222.58
Annotation	Unknow
Peak:m/z	Relative Intensity
375.1329346	0.83
376.1683960	0.35
399.3788757	0.27
400.5653687	0.43
440.8452454	0.90
444.5674744	0.47
456.2335815	0.19
473.6647339	0.22
479.3869629	0.19
483.0457764	0.68
484.2816772	0.37
495.8381042	0.44
501.3746948	0.25
503.0408325	0.21
505.1452942	0.60
512.3783569	0.63
515.5643311	0.96
524.1405029	0.36
543.3770752	0.65
551.6284180	0.25
552.5609131	0.34
568.0756226	0.18
571.4276733	0.45
581.1296387	0.14
586.2201538	1.60
586.9777832	0.43
592.4609985	0.14
593.8660278	0.61
598.5360107	0.19
609.2913818	0.91
616.5140381	2.41
617.1220703	0.14
619.1247559	0.25
631.3021851	2.48
633.0328369	0.40
641.2824707	0.27
644.2279053	1.12
645.0801392	0.85
645.8008423	0.24
655.2940674	0.16
663.9580078	0.98
665.8166504	0.61
669.5094604	0.41
671.0244141	0.11
674.3297729	1.04
676.4382324	0.64
679.2258301	0.35
686.0603027	0.59
687.5137939	0.64
692.5056763	0.27
694.4671631	0.85
704.0285645	0.83
711.7944336	0.90
712.7844238	0.14
716.4938354	0.44
724.6522217	1.88
726.4457397	0.61
730.1013184	0.44
734.7750244	0.77
742.9547119	4.02
743.7808838	3.42
744.6276245	3.09
745.5310669	0.40
746.5809937	0.27
747.4147339	0.38
748.4013672	0.18
752.7124023	0.36
760.3418579	0.15
769.5988770	0.29
771.3734131	0.44
772.3435059	0.14
774.2812500	1.00
778.3748779	2.21
783.3635254	0.15
784.6810303	0.15
785.7347412	0.52
789.5158691	0.65
799.6519775	0.14
801.1759033	0.68
807.5366211	0.39
808.2701416	0.51
816.4600830	0.67
820.8634033	2.13
825.2224121	0.24
826.4887695	1.24
827.6741943	0.18
833.2569580	0.70
837.6280518	6.49
838.4232178	0.73
839.3186035	0.52
840.3164062	0.43
851.2767334	0.90
858.4849854	0.60
861.6958008	0.76
876.0174561	1.98
877.9730225	0.55
879.4196777	1.35
889.8736572	3.16
890.5916748	0.14
892.0505371	0.41
897.8756104	0.21
900.4438477	2.43
903.7174072	1.14
904.3466797	0.15
913.8261719	4.08
914.4566650	2.37
915.6218262	1.51
925.0778809	0.82
925.7459717	0.53
926.4876709	0.79
928.1203613	1.42
930.0897217	0.24
933.5146484	0.35
940.5155029	0.54
944.7172852	0.29
949.9720459	0.76
952.4224854	12.82
953.4508057	0.81
956.8786621	0.60
957.6809082	1.26
958.7899170	0.16
961.1221924	1.11
962.4565430	1.05
970.4492188	0.22
972.4130859	0.63
978.2792969	0.28
980.7371826	0.70
984.5137939	5.51
987.3366699	0.48
989.6486816	14.06
990.4754639	8.13
991.2742920	1.35
993.9240723	4.32
999.0347900	2.06
1014.0756840	0.19
1015.1499020	5.66
1021.4417720	0.39
1023.1293950	0.87
1029.9638670	1.96
1037.6401370	1.28
1046.5510250	0.15
1050.9466550	0.97
1055.5366210	4.34
1056.2353520	2.38
1060.8850100	0.17
1061.7583010	0.21
1066.6877440	0.58
1068.1042480	0.75
1069.8524170	1.51
1072.5443120	0.90
1073.7608640	1.04
1074.5798340	0.60
1075.8753660	0.72
1077.5637210	0.97
1078.6008300	0.89
1082.5150150	0.23
1089.8507080	2.11
1090.9106450	2.57
1092.0061040	0.35
1094.2785640	5.54
1095.6198730	0.51
1096.3652340	0.57
1100.0312500	1.91
1100.6798100	0.16
1102.0876460	1.02
1103.2087400	0.46
1104.1718750	1.34
1107.0083010	4.12
1110.2584230	0.23
1112.3199460	4.24
1113.2517090	2.18
1116.0579830	1.40
1117.2218020	0.87
1122.9332280	6.02
1123.9376220	1.72
1124.7658690	0.82
1128.5743410	3.36
1130.9926760	1.89
1133.4606930	0.67
1137.0388180	0.86
1138.2026370	0.65
1142.0904540	1.43
1143.5456540	0.79
1144.4040530	3.89
1145.3861080	1.23
1146.2570800	2.08
1147.5874020	2.68
1149.0632320	1.21
1150.7941890	1.06
1152.5595700	0.92
1153.9479980	2.45
1154.9702150	1.46
1159.6916500	3.11
1160.5463870	1.09
1162.5655520	1.15
1163.6660160	0.34
1166.5406490	31.01
1167.4631350	3.72
1168.0908200	0.11
1169.1502690	1.59
1170.0354000	1.48
1170.6528320	1.48
1171.7170410	4.16
1172.7597660	3.51
1173.8044430	1.65
1175.2409670	7.68
1175.9792480	4.13
1177.0122070	0.73
1178.4421390	52.83
1179.3684080	0.49
1180.0524900	1.85
1181.0834960	4.42
1183.0098880	0.37
1185.1488040	1.88
1185.8571780	1.33
1187.4951170	0.66
1190.6210940	3.15
1191.6921390	0.39
1192.8874510	3.38
1194.5239260	12.71
1195.3889160	11.10
1196.2498780	2.60
1196.8818360	3.79
1198.2886960	6.86
1199.0921630	2.15
1200.4693600	11.38
1201.4547120	2.90
1203.2724610	21.75
1203.9130860	12.28
1204.8837890	4.92
1205.8745120	100.00
1206.9157710	6.44
1208.1784670	9.55
1208.8330080	8.95
1210.5139160	2.02
1211.5430910	0.30
1213.4741210	0.14
1215.5662840	0.58
1222.0234380	2.96
1223.3612060	0.19
1229.0360110	0.34
1230.9678960	2.20
1231.6784670	1.50
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
145.0837097	8.45
280.9766846	5.99
296.0964661	24.70
308.1911621	15.53
325.8076477	32.72
338.0726624	14.04
362.3165588	9.79
363.3492432	19.20
368.1219788	6.59
385.5589905	14.52
391.1357117	7.82
408.2864685	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	492.1388
Annotation	Unknow
Peak:m/z	Relative Intensity
140.1952362	0.22
143.1469269	0.46
146.1575165	0.07
149.9132690	56.74
160.9445038	3.69
178.9795990	4.80
220.8570251	0.78
233.2319031	0.16
250.0161133	0.23
251.2177124	0.05
262.9342651	2.61
281.0923157	0.51
311.2650146	0.70
323.0235291	1.81
330.1550903	0.21
341.1514587	100.00
354.1176758	0.15
387.0809937	0.11
428.0436401	0.17
473.9942322	0.67
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	300.1801
Annotation	Indicine
Peak:m/z	Relative Intensity
111.9140701	0.21
142.1766052	0.20
150.2416077	0.30
153.7766418	0.11
204.1968689	0.34
218.0965271	0.27
220.2089233	0.10
225.9849243	0.31
246.9903259	0.40
255.0629883	0.94
256.1423035	0.99
257.0986938	0.42
258.4671631	0.25
263.3683777	0.53
265.0663452	100.00
265.6791687	0.58
269.2531433	0.45
271.1533813	0.24
272.0739746	0.28
279.9926758	0.34
281.4101257	2.59
282.0351868	34.14
283.1383057	2.75
284.8388977	0.40
286.1974792	0.33
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	278.0669
Annotation	N-(E-4-coumaroyl)-aspartate
Peak:m/z	Relative Intensity
87.9575729	1.61
93.0131912	1.16
97.0255585	0.12
113.9340210	12.81
114.9479446	7.19
118.9644928	10.58
122.7425308	0.06
126.1408539	0.10
132.0103760	70.18
140.2131348	0.07
141.0966797	0.04
145.0546875	0.74
146.1768341	0.24
147.0270081	0.51
157.9537811	0.64
162.9248047	100.00
174.2229767	0.44
176.9214783	0.06
177.9519958	0.09
179.9690247	0.25
184.9140015	0.05
188.1384125	4.17
189.1041260	0.05
190.1557617	1.32
197.3342896	0.24
203.3879089	0.14
209.1758423	0.10
213.8978271	0.06
216.0532532	35.19
217.1857300	1.53
218.2831116	0.36
220.0538025	0.15
234.0619812	34.73
236.1911926	0.18
241.3627319	0.04
259.5141296	2.78
260.1700439	8.35
261.0755005	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	564.3307
Annotation	Unknow
Peak:m/z	Relative Intensity
168.1753082	0.01
171.3828278	0.02
173.2502899	0.03
202.1285248	0.03
220.0104675	0.03
255.2630005	0.28
269.1388550	0.03
279.3170776	0.44
280.1782532	0.03
289.3696899	0.03
295.7543945	0.03
306.2546997	0.06
308.5333862	0.01
314.0473633	0.06
327.4130249	0.02
391.3403931	0.17
392.2619629	0.09
408.4811401	0.08
409.3764648	0.18
410.2034912	0.01
411.2535400	0.03
415.2779541	0.11
417.4102783	0.03
419.2579956	0.04
426.2680664	0.01
427.9852295	0.02
468.4050293	0.09
469.6087646	0.03
477.5408325	0.01
478.4473877	0.02
504.3752441	100.00
505.1323853	0.45
519.5462036	0.01
520.4941406	0.02
523.3709717	0.02
525.0408325	0.02
528.0888672	0.08
535.8338623	0.10
536.5697632	0.03
545.3526611	0.09
546.1813354	0.05
548.2279663	0.05
556.1503296	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	207.0509
Annotation	Calcium Gluceptate
Peak:m/z	Relative Intensity
73.0250092	0.05
82.8582916	0.39
86.9260254	0.03
88.8828278	0.30
101.9876862	0.31
102.8082581	0.04
113.1385345	0.04
114.9671021	0.18
116.8995667	100.00
117.7213287	0.02
127.0614929	0.10
131.0401306	0.69
134.9372864	0.40
141.0309601	1.50
142.9775696	0.07
145.2103119	0.10
146.9544373	0.14
159.0282135	1.58
160.9981995	0.40
175.0581207	0.65
188.9594727	18.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.0714
Annotation	Deoxyinosine
Peak:m/z	Relative Intensity
100.0227661	0.71
105.0186005	0.57
135.2204742	0.38
137.1182556	0.80
142.978302	0.50
146.18013	0.60
149.2220612	0.62
149.8665009	0.48
155.4603882	0.24
165.2621765	0.77
166.0059967	0.36
169.0867462	0.50
171.1138763	0.45
179.971817	0.71
181.2142181	1.13
182.0634155	0.63
183.3534088	0.77
193.1499786	1.76
195.0513763	1.32
196.0977478	1.19
205.2820282	0.43
206.1842499	1.40
207.0707855	16.18
208.0870514	8.42
209.1206665	3.35
214.9782562	3.94
221.3709259	0.78
222.1051178	9.71
223.1094666	12.68
223.9635773	0.42
232.265274	0.67
233.3181915	2.85
236.2230988	0.46
237.0499268	0.38
240.3341675	0.64
251.0790863	100.00
252.1691132	17.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	334.1311
Annotation	Furametpyr
Peak:m/z	Relative Intensity
121.9732208	0.10
134.9746857	0.33
137.4504089	0.20
155.1674500	0.56
162.8179474	0.33
165.0853882	0.77
177.1371765	0.78
182.9597931	2.92
194.8157654	0.11
200.0526428	0.19
205.0538940	0.16
213.0482178	0.29
236.1671143	0.08
241.7844849	2.01
245.0313721	0.11
246.3030701	0.25
247.9393921	0.30
252.0696106	25.87
264.2487488	0.15
268.2440796	0.38
270.0232849	100.00
270.6793823	0.31
272.0953064	0.31
281.0401306	0.19
281.6729736	0.33
285.0267944	0.33
290.4870605	0.48
293.0560913	0.20
298.1281128	5.18
299.2053528	0.96
301.1228027	0.10
303.8881836	0.21
312.6873779	0.48
316.0224609	4.60
316.7930908	0.15
319.9484253	0.14
324.8327942	0.33
332.6549683	0.09
338.1277771	0.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	471.187
Annotation	Unknow
Peak:m/z	Relative Intensity
143.1128998	0.20
146.9615784	0.20
151.0349426	0.21
152.9321747	0.82
161.1516418	0.32
163.1654358	0.08
169.3014832	0.19
179.0675964	0.27
186.1784363	0.42
187.1807251	0.36
201.1668854	0.53
203.1967316	0.05
204.2335358	0.52
206.9716644	0.47
211.2761993	0.28
214.1352844	0.06
219.2263489	2.65
242.1985168	0.29
243.0639954	0.06
245.1816711	0.37
249.1510620	0.25
253.0614014	0.14
254.1039124	0.22
261.2276611	0.17
263.1674500	100.00
265.3947144	0.09
272.3511658	0.19
277.1136475	0.26
278.3714905	0.08
284.9251709	0.08
287.0723267	1.36
290.7692261	0.08
305.0585327	5.42
308.9447021	1.60
311.6142578	0.10
317.1614990	0.49
325.2687378	0.23
329.2836304	0.05
335.0747986	0.50
339.2657776	0.96
340.4001465	0.29
341.3799744	0.16
347.2489624	0.20
351.1692200	0.50
352.5825806	0.08
358.6396484	0.06
364.2664185	0.13
364.8887329	1.97
375.2280273	0.33
376.5822754	0.16
383.1713867	0.24
384.3648071	0.17
385.2754517	0.23
387.1839294	0.06
391.4248047	0.82
397.5868225	0.09
399.2572937	0.08
409.2243958	0.25
424.9742126	27.89
425.6497803	0.59
427.2320557	1.61
435.2936096	0.46
436.2046814	0.09
438.4020691	0.29
441.4668884	0.04
442.7132568	0.15
451.3141174	0.11
453.0313110	1.27
453.6871643	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	401.0726
Annotation	Unknow
Peak:m/z	Relative Intensity
138.3089294	0.09
147.1295776	0.05
149.1092987	0.09
168.9614563	0.07
170.0091248	0.07
173.1330566	0.05
178.0477905	0.06
181.9889832	0.05
193.1329346	2.89
201.4455261	0.27
203.2536774	0.04
215.0056458	0.09
218.9520111	0.09
220.9110718	0.15
237.0910339	1.26
238.9929810	0.63
241.0553284	0.23
245.0137939	0.16
249.3886108	0.20
253.1391907	0.12
254.8720398	0.08
283.1722107	0.08
285.0474243	0.08
286.1505737	0.04
305.0343018	0.09
306.3371582	0.21
309.1527710	0.10
313.2380676	0.19
315.1346436	0.46
321.3465271	0.21
326.1730042	0.12
328.2701111	0.08
333.0212402	0.05
337.4092407	0.18
339.4399719	0.39
347.2052612	0.17
353.1180725	0.10
355.0902100	12.20
357.2396240	100.00
363.2190857	0.06
365.1592712	0.28
366.3101501	0.11
369.4247437	0.07
371.3168640	0.40
373.3706665	0.04
377.9407654	0.15
381.1454163	0.94
383.1220093	0.48
384.4549866	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	809.5858
Annotation	Unknow
Peak:m/z	Relative Intensity
235.3253632	0.04
261.1112366	0.10
262.9987183	0.22
303.3927612	0.08
331.1783447	0.06
336.2328491	0.23
337.1596680	0.10
348.3267212	0.05
358.1078491	0.03
364.1177979	0.04
372.9387817	0.09
376.0119629	0.35
377.1028442	0.13
401.7224731	0.05
410.1796265	0.30
411.2012329	0.10
412.1352539	0.08
432.0319824	0.08
433.2061768	0.08
440.6089478	0.13
451.3215332	1.48
472.4862671	0.08
479.1131592	0.06
484.4331665	0.03
491.9812012	0.09
495.2673950	0.07
504.9179077	0.09
508.1309814	0.05
512.4974976	0.04
520.9265137	0.18
523.1878662	0.33
524.2111816	0.17
543.3225708	0.11
553.0802612	0.05
554.1215820	0.09
561.6414185	0.17
580.3367920	0.08
581.3120728	0.12
582.2645874	0.10
589.4896851	0.07
596.5488892	0.12
598.2498779	2.70
599.2559204	0.67
600.3895874	0.10
605.9471436	0.09
629.3201904	0.07
636.5748291	0.21
640.3544312	0.05
645.3647461	0.04
660.6881714	0.11
665.0179443	0.03
669.8444824	0.07
682.8070679	0.08
690.5912476	0.53
691.6123047	0.02
692.5549927	0.10
695.3303223	0.07
702.4895020	0.58
703.3212891	0.09
711.2025757	0.04
719.9407959	0.62
721.6738281	0.07
722.5461426	0.03
725.1640625	0.16
726.3824463	0.41
727.2626343	0.09
728.1405640	0.14
734.5039062	0.09
739.1500854	0.16
739.8451538	0.62
742.9121704	0.59
743.8147583	0.07
750.8002930	0.39
752.3718872	0.29
763.4452515	0.26
765.0437622	0.09
766.4813843	0.80
768.4939575	0.75
769.5921021	0.21
770.3679810	0.05
772.2810059	9.58
773.5490112	0.66
774.5145874	0.20
776.0526123	0.38
777.6333618	0.11
778.2995605	0.06
779.2517090	0.12
780.9352417	0.25
781.9044189	0.06
783.5922241	0.05
786.0524902	0.37
788.4788208	0.80
789.6143188	0.34
791.3889771	1.91
792.0120850	0.03
794.9049683	100.00
796.4386597	4.26
797.3898315	2.75
798.0744019	1.21
799.1080322	0.96
800.1502686	0.04
801.0262451	0.27
802.6599731	0.05
803.4545898	0.40
804.3732910	0.22
805.6019897	0.24
806.4162598	0.09
807.6942749	0.23
814.5536499	0.04
815.2291870	0.04
816.3552856	0.29
820.2298584	2.16
822.7284546	0.12
823.7158203	0.07
829.0780029	0.06
829.9365234	0.18
830.6205444	0.22
831.5320435	0.18
832.1479492	0.05
834.5272827	6.34
835.4555664	0.07
836.5713501	0.04
838.8364868	0.08
840.2984619	0.07
841.0346069	0.25
842.5691528	0.08
843.7362671	0.37
847.2805786	0.17
851.3787231	0.31
853.5119019	0.18
854.5359497	0.17
855.7112427	2.30
856.3746338	0.09
857.2376099	0.05
858.3870239	1.35
860.4451904	0.14
862.7420654	26.50
863.8184814	0.79
864.9503174	0.67
865.7501831	0.06
866.7636108	0.11
867.5438843	0.12
871.9055786	0.32
874.7173462	0.08
875.4245605	0.04
878.4407349	0.12
880.9138184	0.35
888.1772461	0.15
890.6968384	0.24
891.8900757	0.56
892.6610718	0.51
893.6708984	0.05
895.0959473	0.87
895.7221069	0.07
899.5073242	32.26
900.5034790	0.44
901.3265991	0.29
903.0261841	0.27
903.6840210	0.04
904.9519653	0.16
906.7687988	0.20
907.5871582	0.07
913.5571899	0.04
915.0891724	0.43
916.3633423	0.17
919.6991577	0.29
921.3710938	0.08
923.7595215	0.76
924.7590942	0.12
925.7300415	0.07
928.3029785	29.69
929.2636719	0.95
930.2953491	0.39
931.0420532	0.09
932.3218384	0.19
936.0380249	0.49
937.2034302	0.12
942.7841187	0.11
944.3372192	0.13
945.5895386	0.14
946.2949219	0.22
953.5711060	0.03
955.9739380	0.24
957.1026001	0.21
958.0764160	4.42
959.1260376	0.28
960.5015259	0.64
961.3874512	0.07
962.9321899	0.16
964.4724121	1.04
965.1064453	29.01
966.2663574	0.71
967.0125122	0.01
967.8437500	0.36
969.1599731	1.60
969.9169312	0.32
970.7717896	0.03
973.0366211	0.03
975.1620483	0.38
975.9197388	0.03
981.7458496	0.09
985.9404297	0.17
1002.6951290	0.22
1003.4718630	0.26
1013.3355100	0.05
1015.7348020	0.03
1016.6984860	0.04
1017.6352540	0.21
1020.5275270	0.09
1021.6289670	0.12
1026.8419190	0.30
1027.7695310	0.09
1030.4665530	0.09
1032.1738280	0.12
1034.1140140	0.22
1034.8215330	0.04
1035.5983890	0.11
1037.5178220	0.10
1040.7829590	0.22
1041.6059570	0.51
1046.1782230	0.25
1047.1452640	0.13
1048.5319820	0.12
1051.9239500	0.04
1055.6748050	0.04
1062.4001460	0.02
1065.9188230	0.10
1068.5683590	0.12
1070.1311040	0.09
1073.5108640	0.17
1075.3195800	0.03
1076.6286620	0.21
1077.9805910	0.09
1087.3072510	0.09
1089.1145020	0.09
1090.6269530	0.38
1091.6479490	0.03
1093.1805420	1.06
1094.5310060	0.40
1101.8489990	0.14
1104.5190430	0.06
1106.7592770	0.10
1112.2297360	6.72
1113.0072020	0.40
1114.5622560	0.07
1117.0092770	0.17
1119.6779790	0.06
1130.6813960	0.21
1136.2341310	0.12
1138.7775880	0.11
1140.9102780	0.63
1144.1755370	0.25
1147.5644530	0.16
1149.8507080	3.82
1150.7734380	0.08
1158.6254880	0.13
1160.7724610	0.45
1173.0490720	0.07
1173.7238770	0.07
1180.4946290	0.05
1181.9222410	0.19
1182.8558350	0.05
1184.1785890	0.23
1189.0036620	0.08
1190.7509770	0.14
1191.5777590	0.41
1192.7193600	0.19
1193.3840330	0.12
1195.6859130	0.07
1198.7668460	0.26
1199.8839110	0.05
1201.9409180	0.13
1206.5808110	0.03
1209.8377690	0.13
1212.8590090	0.10
1215.3327640	0.24
1216.9833980	0.05
1221.0260010	0.12
1223.8259280	0.36
1224.8542480	0.07
1230.6081540	0.09
1231.9150390	0.30
1237.5090330	3.39
1238.4302980	0.68
1241.9307860	0.07
1244.6901860	0.07
1251.1455080	0.08
1257.7618410	0.04
1260.2030030	0.28
1262.6990970	0.17
1263.8521730	0.09
1287.8370360	0.16
1307.7364500	0.11
1310.2100830	0.21
1312.7498780	0.03
1323.5489500	0.07
1325.5133060	0.07
1327.7263180	0.04
1338.7801510	0.03
1346.1934810	0.07
1346.8529050	0.09
1353.7467040	0.10
1356.3474120	0.03
1361.4129640	0.05
1370.7536620	0.08
1376.6018070	0.03
1382.7323000	0.12
1392.3038330	0.11
1396.3270260	0.03
1398.6658940	0.06
1399.5723880	0.09
1403.7673340	0.13
1409.3439940	0.14
1417.5676270	0.20
1418.1856690	0.07
1420.0939940	0.21
1423.5777590	0.04
1431.9226070	0.09
1433.9783940	0.06
1439.5765380	0.11
1443.5197750	0.03
1445.7520750	0.07
1446.6134030	0.10
1479.6959230	0.09
1480.9211430	0.05
1493.0460210	0.08
1505.5573730	0.04
1512.3756100	0.07
1538.1779790	0.41
1544.3463130	0.03
1545.3946530	0.09
1553.4185790	0.10
1567.6790770	0.15
1568.9287110	0.03
1590.9849850	0.05
1600.7595210	0.05
1602.0052490	0.18
1607.1024170	0.05
1634.7296140	0.09
1660.9761960	0.03
1668.7156980	0.12
1678.9737550	0.15
1684.9367680	0.04
1705.9251710	0.09
1738.7264400	0.11
1752.1639400	0.06
1770.7279050	0.14
1777.3801270	0.08
1785.1698000	0.03
1795.6097410	0.67
1796.9058840	0.05
1801.7791750	0.08
1805.0397950	0.09
1833.9167480	0.03
1843.4268800	0.51
1850.5780030	1.98
1859.0894780	0.02
1865.0311280	0.06
1866.5723880	0.02
1874.4034420	0.09
1879.0354000	0.04
1896.9461670	0.08
1899.7674560	0.03
1907.9117430	1.50
1913.0284420	0.47
1913.9925540	0.04
1918.2010500	0.03
1919.8278810	0.64
1922.8228760	0.34
1925.1058350	0.03
1926.4732670	2.02
1927.2557370	0.07
1937.6956790	0.05
1944.4051510	0.20
1945.9993900	0.03
1948.8137210	0.07
1951.1036380	0.16
1951.9273680	0.56
1952.9459230	0.04
1955.1951900	0.86
1956.4182130	0.02
1957.0896000	0.03
1960.5017090	1.17
1964.0198970	0.03
1966.1407470	0.06
1967.7169190	0.19
1969.1994630	0.59
1975.4654540	2.19
1977.2252200	0.03
1978.3328860	0.30
1983.4259030	3.41
1993.5589600	3.10
1995.3736570	0.11
1998.6115720	0.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	693.2045
Annotation	Sesaminol glucosyl-(1->2)-glucoside
Peak:m/z	Relative Intensity
201.1439056	0.64
203.0702209	0.06
205.0515442	0.13
209.1530304	0.03
212.3496094	0.04
217.2230225	0.40
220.9893494	0.32
223.0896606	0.70
229.1882324	2.95
232.1194153	0.03
233.1145325	0.10
247.0775452	0.10
253.5762634	0.03
265.1641846	0.03
271.2373047	0.63
277.4004517	0.08
289.1848145	0.42
305.3100281	0.04
322.9167480	0.07
323.5628357	0.09
325.1178589	0.16
330.9580078	0.03
333.4964600	0.04
335.2338867	0.05
350.7306519	0.05
358.5668335	0.03
367.1594849	0.36
397.2538452	0.06
409.0647583	0.10
423.1024170	0.05
427.3510132	0.38
432.2267456	0.15
442.4513550	0.04
451.3159180	0.48
455.2317505	0.02
457.2958984	0.15
469.2396851	100.00
487.2001343	0.65
489.5047607	0.03
494.3840942	0.06
495.1810913	0.13
511.4105225	0.11
515.1993408	0.16
526.1814575	0.07
529.3090820	1.32
530.6968994	0.10
531.3551025	0.16
584.5515137	0.03
587.7575073	0.14
594.9824829	0.06
597.2551270	0.16
604.5357666	0.09
605.4826050	0.08
646.4479980	0.07
648.5281372	0.23
649.2017212	0.05
660.5053101	0.04
675.4893188	0.51
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	209.0666
Annotation	Sedoheptulose
Peak:m/z	Relative Intensity
68.9849625	0.67
70.9213791	1.33
82.9753876	0.91
84.9694672	8.86
85.8295136	0.08
86.9709473	12.20
88.9234009	0.81
96.9545746	3.26
98.9217987	6.14
100.9770508	0.43
110.9798889	11.62
113.0244904	0.29
114.9402008	4.91
119.1552734	0.04
126.7788239	0.07
128.9204712	100.00
130.8630219	0.27
133.1230164	0.27
141.0484467	10.44
142.9305420	0.11
144.8707428	0.08
148.7833710	0.09
158.9242249	48.65
162.8914337	0.32
165.1532745	0.55
176.9726868	0.79
190.9720917	2.24
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
174.9859161	1.45
176.0307770	0.17
202.2505951	0.08
231.1041565	0.12
272.9254761	0.19
288.9359131	0.07
359.0759888	0.08
403.0974121	0.11
443.0556030	0.77
443.8920288	0.08
445.1011963	0.06
486.1622925	0.22
487.1124268	0.22
488.6902466	1.47
489.3108521	0.32
493.0101318	0.12
499.9624634	0.08
501.2029419	0.07
506.7012329	0.08
512.1525269	0.12
528.0007324	0.10
528.8401489	0.08
544.3651733	0.06
546.0301514	0.07
556.8532104	100.00
557.8686523	0.80
558.7761841	0.31
562.8493042	0.04
574.8708496	0.05
584.2081909	0.36
585.1397705	0.67
592.1220703	0.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	282.0967
Annotation	4-Hydroxyphenylacetylglutamine
Peak:m/z	Relative Intensity
88.0473480	0.09
94.6991730	0.12
106.9149628	0.07
114.9528885	0.13
115.9230804	0.62
119.9515533	0.25
122.0020905	0.07
123.0185242	0.09
137.2359009	0.06
138.6748047	0.27
147.0469360	0.12
156.6810760	0.09
161.1595459	0.16
166.0479431	4.77
178.4761505	0.11
182.1763763	0.12
184.9193726	0.14
193.1263733	0.16
200.6951904	0.44
205.1005554	0.17
206.2658997	0.14
207.2055969	0.10
213.2547913	0.23
215.3927307	0.09
218.0987854	0.62
229.0150146	0.21
235.9853516	75.21
237.1188965	1.11
238.1770020	0.20
239.1857605	0.12
240.1159973	0.16
241.0094604	0.07
245.2231445	0.30
245.9790649	2.45
246.9431152	0.05
252.2002869	0.15
263.9693604	100.00
264.9842224	0.69
266.3614502	0.19
267.5763550	0.10
273.0577698	0.82
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
95.31941223	0.13
97.04794312	0.56
107.0258102	0.23
111.1489029	0.10
119.0315857	0.08
120.8956985	0.29
125.2110138	0.17
126.8246613	0.23
128.8639832	0.09
130.7919922	0.12
136.0659027	0.08
139.0176086	0.38
141.0463562	0.16
141.9689636	0.12
151.0161133	0.42
152.9282227	0.20
157.2147522	0.14
163.1161346	0.24
169.1017151	1.09
170.9772644	0.40
173.0869446	0.09
175.146637	0.13
176.9022369	0.26
181.031723	0.30
183.2645111	0.90
186.7522736	0.11
189.2271271	0.27
192.1919098	0.28
197.1147461	1.07
198.4326477	0.14
205.2129822	0.73
207.5341187	0.19
208.2154846	0.12
209.1468811	0.96
211.0659485	0.94
213.4203796	0.36
214.9912415	0.18
219.3751526	0.18
223.0661926	0.19
225.1390686	0.12
227.1746521	0.17
228.1719971	0.08
229.1755371	0.18
233.2583313	0.09
235.2570496	0.36
237.0376892	15.15
239.5942688	0.15
241.20224	0.15
247.1302185	0.76
249.1464844	0.31
250.2498169	0.08
251.2119446	0.71
253.0529175	2.00
255.1144714	17.31
257.2692566	0.26
264.3858337	0.37
265.1987305	0.81
267.2154236	0.18
268.2701111	0.27
269.2263794	1.14
270.1191406	0.67
270.9266968	0.08
275.1396179	3.38
276.1620178	0.37
279.4823608	0.10
283.3757935	1.79
290.0875549	0.54
291.9055176	0.48
293.2147522	100.00
294.0462036	0.42
295.9064331	0.52
302.3146973	0.11
311.0903931	0.24
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	385.1137
Annotation	3'-O-beta-Glucopyranosyl plumbagic acid
Peak:m/z	Relative Intensity
112.9340973	0.23
120.9436340	0.05
142.9908752	0.03
147.0896759	0.02
149.0723572	1.13
158.8577423	0.03
160.9854126	0.03
164.0808258	4.21
175.1529846	0.11
179.1097717	1.45
187.8157959	0.07
190.0316772	4.20
195.2689667	0.03
201.1698761	0.02
203.0665894	0.21
205.0450287	54.64
206.0411072	0.25
208.1382904	1.06
218.1175232	0.02
218.9717712	0.14
221.0811157	1.28
223.0572357	100.00
232.1243591	0.64
233.1544800	0.67
236.9943237	0.70
237.5963745	0.04
247.0207825	57.92
248.8954468	0.03
251.0631714	0.15
261.0658264	0.04
263.2055054	0.46
265.1429138	8.97
275.2155151	0.19
277.0739136	2.52
285.1359863	0.07
287.0812988	0.08
289.0582886	0.98
295.1206055	5.30
305.2531738	0.31
307.0889893	0.13
316.3605347	0.07
325.2301025	5.56
339.4790649	0.04
341.2675781	0.04
349.3872070	0.08
355.3204956	0.06
367.2243347	2.18
369.1603699	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	330.1175
Annotation	Lithospermoside
Peak:m/z	Relative Intensity
94.0500031	0.07
121.8850555	0.17
144.5491638	0.02
149.9677124	32.88
151.3678894	0.18
167.9934692	100.00
176.7434845	0.30
227.8954163	0.09
243.9110718	0.07
245.0252380	0.06
245.9004211	0.19
264.1836548	0.15
295.1071777	0.50
312.3408813	0.56
312.9733276	0.31
321.1213379	0.39
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	738.93
Annotation	Unknow
Peak:m/z	Relative Intensity
210.8818359	0.07
241.1978302	0.53
280.1429138	0.04
310.8930054	0.02
323.0819702	12.02
329.0641785	0.05
349.0893860	0.04
358.9617920	1.03
361.1163940	0.05
362.0714111	0.03
366.0431519	0.05
377.0124512	0.67
385.0541992	0.03
390.9041138	0.13
405.8646240	0.02
423.9720459	0.06
430.9151611	0.02
441.1614380	0.51
442.8975830	0.05
449.3550415	0.10
458.9877319	2.66
464.9382935	0.02
466.6709595	0.08
470.9836426	0.03
483.1341553	0.84
491.1221924	0.12
495.0138550	1.41
496.9937744	0.19
508.0635376	0.03
508.8858643	0.17
511.8632812	0.02
516.3153076	0.02
526.8661499	0.03
549.5262451	0.04
550.6564331	0.27
552.9979858	0.02
560.2373657	0.88
564.8340454	10.51
568.7575073	0.06
570.7279663	0.11
572.0589600	0.03
577.0801392	0.25
578.6546021	0.05
582.7749634	0.08
583.9065552	0.06
585.1110840	1.37
588.8828735	0.03
602.9844360	100.00
603.7896118	0.69
608.9459229	0.03
619.0922852	0.43
627.0282593	0.04
640.6603394	1.11
650.6312866	0.05
651.7024536	0.47
652.5780029	0.58
654.6453247	3.41
662.8024902	0.08
670.8712158	0.04
688.0752563	0.09
691.8810425	0.14
692.8702393	0.96
695.5984497	0.25
696.3053589	0.12
702.9802856	0.06
707.2757568	0.08
720.8542480	0.97
721.6118774	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	281.0699
Annotation	Ala-Abu-OH
Peak:m/z	Relative Intensity
79.84099579	0.71
87.08250427	0.25
96.84698486	43.94
98.85182953	0.18
123.10215	0.45
139.1436157	0.38
149.930603	2.81
173.0997162	0.85
175.9852295	0.59
179.056778	0.12
180.2523804	0.94
184.9228363	0.14
191.1822662	0.40
194.0867004	0.17
199.0559082	0.64
200.9935303	3.69
207.3968201	0.37
209.2300415	0.10
210.045929	0.24
215.0673828	0.30
217.1250305	1.16
219.2087097	0.54
221.2134399	0.80
222.9785767	0.72
224.9728088	0.53
233.1500854	0.14
234.9550476	1.78
237.0848694	100.00
238.1442261	0.20
244.2014771	0.32
261.0634155	0.16
263.037262	8.75
263.6939087	0.18
275.0406494	0.53
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	325.0927
Annotation	6-O-p-Coumaroyl-D-glucose
Peak:m/z	Relative Intensity
97.0280533	0.44
112.8987885	0.13
117.0070801	2.70
118.9340668	12.35
124.0351868	0.08
143.0377197	0.07
144.9374390	100.00
158.9851685	0.58
161.0619812	1.22
162.9362030	89.77
163.7798157	0.14
173.0230408	0.59
175.0155334	0.13
177.0467834	0.78
182.9157562	0.08
185.0624695	0.12
187.0036621	60.87
189.1201477	0.40
191.0859375	0.54
200.9507599	0.12
203.0434570	0.35
204.9263916	8.55
207.0803833	0.11
215.2701416	0.19
217.0626526	3.80
227.1427307	0.07
229.0402222	1.89
230.9896240	0.13
235.1208801	10.52
245.1118469	0.88
247.0920105	0.07
261.2929688	0.09
262.9624634	0.42
265.1809692	20.32
267.4545288	0.12
277.0772705	0.11
279.2993469	0.38
281.1594849	2.12
282.5898132	0.08
292.8154297	0.12
296.9247437	0.05
305.5048828	0.11
307.1679382	3.11
309.5182190	0.06
325.4192505	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	477.064
Annotation	4-Methoxyglucobrassicin
Peak:m/z	Relative Intensity
137.1661072	0.07
138.7559052	0.08
144.1994629	0.09
154.0572205	0.45
155.0693512	0.21
155.7595367	0.08
160.7745819	0.05
164.1489563	0.06
188.1308136	0.09
188.9824219	0.14
192.9906311	0.09
201.0661011	0.30
202.1201782	0.12
204.0849609	0.12
205.3314819	0.04
207.1761932	0.13
224.0696564	0.65
225.2205505	0.74
226.0167847	0.37
227.2101440	0.16
229.1305084	0.16
235.2690887	0.06
243.1153412	0.08
245.3137817	0.05
251.8288269	0.43
253.0939941	0.06
257.3419495	0.11
259.0300903	1.75
260.0091248	0.52
261.1801147	0.39
269.0804443	0.36
269.9364014	0.04
270.9704285	0.11
273.2207642	0.04
273.8987122	0.27
276.0859070	0.06
277.1360474	0.21
281.1544495	0.11
283.0921021	0.34
284.0500183	0.62
284.9879150	0.92
286.0800781	1.43
287.1183167	0.27
290.0624084	0.04
291.0427246	0.11
292.7229309	0.15
293.4700623	0.08
296.2828369	0.23
297.1578369	0.05
299.5018921	0.22
300.1542358	0.40
301.2873840	0.08
303.1692505	0.23
306.3337097	0.38
315.1167908	0.55
315.9878540	0.06
317.3117676	1.40
318.1909790	0.17
330.1907043	0.17
330.9650879	0.11
333.0952148	0.14
339.3708496	0.11
342.3065491	0.08
352.2096252	0.20
353.2708740	0.09
355.4691467	0.05
357.1450195	0.05
358.3076782	0.17
363.2409058	0.05
367.2523804	0.10
368.1183777	0.20
371.3166809	0.10
375.2709351	0.06
377.2328796	0.07
378.2964783	0.05
381.2314758	0.03
383.2911987	0.10
384.2737732	0.61
391.6732483	0.20
393.3200989	16.32
398.9849548	0.26
405.3950500	0.04
414.3464355	0.21
415.3036499	0.26
416.0267639	0.24
417.0166931	0.86
418.2544556	0.42
424.2498474	0.04
431.4261780	0.04
432.7440796	0.14
433.4033508	0.26
435.2046204	73.69
435.8365784	0.12
439.9314880	0.09
442.3171082	0.66
443.0487976	0.17
446.3667603	8.94
447.1579895	83.12
448.1473083	100.00
449.1309814	31.52
449.7578735	0.06
459.3722839	0.06
461.2516785	2.49
462.0230103	0.09
462.9404907	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	481.2028
Annotation	Unknow
Peak:m/z	Relative Intensity
177.9407349	0.05
187.1021729	0.10
189.1272888	0.03
202.9578857	0.02
205.1212463	0.05
224.9689331	0.07
233.2227173	0.11
256.9475708	0.18
259.2842712	0.09
277.2559204	4.23
279.3172607	0.05
284.0750427	2.70
287.3366089	0.03
294.2459106	0.12
295.2661743	0.10
301.1817627	1.82
302.0009155	0.45
303.2940063	0.03
319.2692566	100.00
320.2753601	0.34
361.0893555	0.04
368.3669128	0.10
368.9856567	0.03
387.3854980	0.02
389.1762390	0.03
391.4651184	0.03
421.3728638	0.21
425.1665039	0.05
433.8207092	0.14
439.3087463	0.50
444.8096924	0.19
446.6272278	0.11
461.6587830	0.06
463.3983459	0.64
464.1816101	0.04
479.2648010	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	232.88
Annotation	Unknow
Peak:m/z	Relative Intensity
96.8426514	100.00
97.5942841	0.03
109.7167358	0.12
164.8828735	0.05
186.9930267	0.36
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	439.09
Annotation	Bikoeniquinone A
Peak:m/z	Relative Intensity
128.9598846	0.27
137.9400635	0.62
142.0690613	1.38
155.9404449	0.11
158.0172119	3.81
158.7949829	0.87
172.0809784	0.44
175.1259155	0.32
179.0513000	0.34
188.0534363	0.32
200.0859070	0.12
202.0339203	6.87
202.9932709	0.71
218.0716553	0.62
218.9044647	0.42
220.2184296	0.24
221.2102509	0.31
245.3597412	0.17
259.0513000	12.26
262.0406799	100.00
263.1099854	18.23
277.1506653	2.38
306.2942200	0.33
317.9738770	0.15
322.9127197	0.40
341.1117554	7.55
379.1024475	0.93
403.3495178	0.22
421.1828918	5.90
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0855
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
94.98321533	0.28
96.04095459	0.07
103.114624	0.08
109.1328278	0.15
121.1631927	0.08
122.0093231	0.07
129.0364838	0.36
130.9228516	0.46
134.9597931	0.21
136.9644318	0.15
142.7087555	0.08
145.9846344	0.09
146.9382019	0.29
149.1833954	0.32
150.9783478	10.69
152.0274963	2.59
154.1518097	0.07
155.1701202	0.32
156.1961823	0.16
157.9630127	0.12
159.1700287	0.09
164.7867889	0.06
166.1668091	0.41
167.253479	0.18
168.0770111	0.66
169.0430756	0.07
170.1400299	0.27
172.0488434	0.13
177.2631073	0.36
178.1279449	0.09
179.2751923	0.42
180.0852203	0.31
181.7839661	0.15
185.2166901	0.09
186.1530762	0.08
188.0518036	0.29
190.0875092	0.37
194.1053314	0.08
195.1089935	0.07
195.9626465	0.09
197.0898895	0.77
198.2984772	0.10
206.1184082	3.77
207.0007782	0.26
208.1485748	0.41
209.1420288	0.09
210.1280365	0.31
211.1022949	1.02
212.1190796	0.41
217.2163544	0.62
218.0767212	1.55
219.0764923	0.14
224.0526886	0.26
225.1935272	2.37
226.1310425	1.07
235.9317169	10.84
237.0005951	0.55
238.0701904	2.28
239.256897	0.90
244.710144	0.27
253.0896606	100.00
254.0989838	2.72
255.14888	0.46
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	272.96
Annotation	Ribose-1-arsenate
Peak:m/z	Relative Intensity
114.9237442	4.50
130.9790955	0.30
158.8883362	100.00
198.9892883	2.10
216.9826355	0.88
228.9155579	25.50
229.5439148	0.05
244.9634399	0.37
253.1955566	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	397.1537
Annotation	Unknow
Peak:m/z	Relative Intensity
152.9354858	0.08
155.1353302	0.07
187.2209778	0.11
192.0612793	0.26
204.9355164	0.21
227.0296326	0.08
255.3764343	0.50
257.1952515	3.30
267.2073975	0.09
271.0111694	0.17
281.0425415	0.13
299.2680054	2.93
305.1245422	0.26
311.2582397	0.34
313.0355225	0.07
315.2374573	0.33
317.3050842	100.00
320.9750977	0.05
334.3455811	0.24
335.2878418	6.17
337.2612305	4.14
339.3754578	0.25
341.0887451	0.09
351.1129456	0.44
353.2658386	0.84
354.9618835	0.08
361.2875671	0.47
369.2603149	0.24
377.3468933	0.45
378.6727600	0.23
379.3522034	1.40
381.5627747	0.08
382.5412903	0.41
397.1970520	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	477.064
Annotation	4-Methoxyglucobrassicin
Peak:m/z	Relative Intensity
138.7900696	2.31
144.7574921	1.41
162.9228363	2.79
167.9223328	1.93
174.4352264	1.32
183.8869629	0.71
192.0042572	0.95
194.9892578	9.44
199.1143799	1.77
201.5673218	2.50
204.0251617	1.19
217.0230713	0.53
226.7672119	3.17
235.1166382	26.16
241.0869293	3.70
254.1280823	2.49
257.2731018	1.01
259.0187073	100.00
267.0956726	0.83
274.9878845	72.28
281.1527100	19.17
283.9952698	11.36
285.9410706	2.59
291.0968018	26.31
299.1593018	15.86
315.3059082	1.14
319.0888977	1.19
328.2482300	1.37
356.3095398	8.21
397.2323608	6.36
431.1435547	6.13
441.2375183	0.77
458.3092041	2.84
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	448.75
Annotation	Unknow
Peak:m/z	Relative Intensity
253.1802368	0.27
280.9609375	0.83
284.9517822	0.15
296.8132935	0.73
298.8923645	0.29
312.8902588	0.33
350.1397705	0.14
350.9196472	0.83
358.9046631	0.11
364.8080750	100.00
380.7745361	13.37
404.7651062	0.31
407.9624939	0.35
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	540.93
Annotation	Unknow
Peak:m/z	Relative Intensity
144.7773438	0.76
311.1506348	0.24
313.0787354	1.20
386.2469482	0.49
401.6349487	1.08
410.9589233	0.61
426.9765625	100.00
427.8610840	0.76
442.2982788	0.35
443.2113037	0.72
444.0441895	1.23
445.2101440	0.58
477.3713989	0.38
484.4478760	0.62
493.0557251	0.95
494.0020752	4.34
494.9522705	25.19
495.9550781	1.77
500.1036987	0.65
502.7952271	1.36
511.8504028	2.40
512.7337036	5.56
513.6254272	3.33
517.2001343	1.91
523.2821045	0.47
528.6768799	0.26
535.5017700	0.70
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	361.1503
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
112.9840469	0.31
114.0911865	0.09
121.0191040	0.10
122.1923981	0.15
126.9041595	0.13
140.0225830	0.12
148.9302063	0.12
151.1855469	0.06
153.9686584	0.14
155.0392914	8.68
161.0444031	0.13
165.3456421	0.10
169.0320435	0.19
199.0559998	100.00
200.8967133	1.08
209.2498474	0.50
213.1703796	0.25
241.0540466	1.25
245.1773376	0.37
261.3093262	0.10
270.5545349	0.13
271.3344116	0.46
282.9512634	0.18
286.5077515	0.28
289.0386047	0.14
298.7281494	0.09
301.1180725	3.16
302.3000793	0.12
307.1258545	0.11
313.3291626	0.40
315.3274536	0.44
317.2529907	0.77
319.0508423	0.24
325.2459106	0.39
342.1469421	0.28
343.1941528	1.88
344.5541382	0.73
345.2830505	0.30
345.9046021	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	478.2939
Annotation	PC(15:1(9Z)/0:0)
Peak:m/z	Relative Intensity
140.0064240	0.04
152.9412231	0.21
175.7597046	0.01
196.0805359	1.58
209.1776581	0.05
214.1104126	1.11
223.1191101	0.02
227.2744141	0.02
233.0536499	0.04
253.1625671	0.04
261.2136230	0.03
263.2056885	0.01
266.6096191	0.02
279.3572083	0.03
281.2598267	100.00
309.0747681	0.01
324.0785522	0.01
329.2657471	0.02
335.8931580	0.06
341.3363953	0.02
346.8246155	0.05
364.5076294	0.01
388.2459412	0.01
394.0295105	0.05
402.9989319	0.01
414.4021301	0.03
417.2841492	0.28
421.4487610	0.07
423.5097961	0.03
424.3786011	0.03
429.3780518	0.02
431.5850220	0.02
432.2373352	0.09
433.4838562	0.05
435.8710938	0.01
441.3193665	0.03
442.2686768	0.07
447.3872681	0.04
450.3356018	0.03
452.6413269	0.01
459.5120544	0.14
460.4992676	0.07
461.6731567	0.07
462.6902771	0.02
469.2978210	0.02
477.6421204	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	426.95
Annotation	Unknow
Peak:m/z	Relative Intensity
154.7133942	0.05
171.1287537	0.07
182.9490051	0.12
184.3111572	0.15
198.8440247	4.28
200.0403900	0.06
216.8301392	0.85
220.3213348	0.19
246.7699890	0.21
270.9153442	0.09
296.5687561	0.14
300.4673462	0.37
309.6791077	0.08
311.0220642	1.40
312.9122314	100.00
314.0226135	3.74
315.1265869	0.30
323.6160278	0.04
327.9092102	0.20
329.1590576	1.41
329.9690857	1.92
330.7210999	13.90
331.6065674	0.23
341.0736694	0.21
346.1698608	0.31
347.9576721	0.68
348.5857849	0.78
349.7413940	0.17
352.9564514	0.95
354.1459351	0.50
355.0604858	0.23
357.9005127	0.12
371.9044495	0.20
372.7430725	0.08
380.9349670	3.21
382.3716125	0.30
383.0451965	0.24
384.2346802	0.54
385.0766296	3.03
386.0216064	12.18
397.1393127	0.08
398.7125854	1.91
401.1711426	0.18
402.3186340	0.32
403.5327454	2.41
404.9146423	0.08
408.9647522	0.53
412.6555481	0.31
417.0947571	0.38
417.7514038	0.26
426.9825439	0.15
436.6374207	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	306
Annotation	Unknow
Peak:m/z	Relative Intensity
113.9160156	3.86
114.9630890	1.12
130.0235901	0.27
178.2809448	0.19
185.2538147	0.14
189.0744019	1.78
190.1114044	0.39
207.0117798	0.06
216.1015625	0.44
217.2127075	0.20
230.8493042	0.50
239.1065674	0.46
242.0125122	100.00
244.0334167	0.88
258.2354126	0.48
261.1020813	1.26
262.5527954	0.67
287.0008545	0.66
288.1812744	2.27
288.8430481	0.45
297.3261719	0.34
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	464.74
Annotation	Unknow
Peak:m/z	Relative Intensity
217.0686798	0.18
250.9821472	0.19
251.9593201	0.17
253.1121216	0.09
292.7354736	0.34
294.8488159	0.52
296.7582397	0.20
312.2215271	0.29
333.1821899	0.24
374.7916260	0.11
380.6756592	18.04
381.3655090	0.29
418.6902466	100.00
419.3656616	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	441.175
Annotation	[3aR-(3aR*,5E,7R*,9Z,11aR*)]-2,3,3a,4,7,8,11,11a-Octahydro-7-hydroxy-6-methyl-3-methylene-2-oxo-, beta-D-glucopyranosyl ester cyclodeca[b]furan-10-carboxylic acid
Peak:m/z	Relative Intensity
181.1823730	0.41
184.0174866	9.79
198.1027679	2.75
240.1089172	64.49
258.1549072	53.42
272.0877380	3.98
278.3390808	0.82
287.1636353	100.00
292.3034058	0.73
312.2059021	0.85
320.2996826	0.57
377.3402405	0.94
382.2025452	1.66
404.2562561	0.44
423.1361084	8.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	611.1979
Annotation	Durantoside III
Peak:m/z	Relative Intensity
179.3289032	0.05
180.0726624	0.48
182.9527740	0.09
192.9401398	0.15
194.3094940	0.17
195.0768433	1.30
196.7106171	0.04
208.1334229	2.00
210.1564026	0.20
211.0307465	0.17
221.1791382	0.08
223.1011810	16.61
224.9997559	3.85
233.4520264	0.06
237.2572021	0.05
241.0908813	0.06
258.0346069	0.06
262.9300842	0.12
265.0778198	0.92
272.1454468	0.23
276.7497253	0.06
280.1206360	0.07
284.1123047	0.11
284.9240723	0.27
286.4180908	0.23
293.4078979	0.06
295.0296021	0.10
304.0924683	0.04
306.1622314	0.24
306.9378662	0.11
308.3699951	0.05
310.2316284	0.08
320.8306274	0.06
327.3297119	0.12
335.4079590	0.03
339.0899048	0.04
349.9616089	0.03
357.4204712	0.04
361.5504150	0.04
363.3233032	0.24
367.2479248	0.04
375.5617676	0.05
379.3961182	0.05
385.4431152	0.34
386.2036133	0.09
388.3145142	0.07
392.5949097	0.04
395.1406860	0.03
401.1096802	3.02
403.1918335	0.49
415.1970215	0.11
429.4147339	0.20
430.3753662	0.35
431.2213135	0.38
443.2984009	0.03
446.7587280	0.04
449.0486450	100.00
449.7077637	0.55
473.9327393	0.03
477.0456543	0.06
480.1256714	0.10
481.2351685	0.09
482.2026978	0.07
491.1795044	1.92
503.1189575	0.08
504.2463989	0.12
507.3689575	0.03
508.3213501	0.04
519.5891724	0.03
520.9824219	0.67
523.1556396	0.14
525.3672485	0.97
526.0960693	0.04
527.0301514	0.11
533.2672729	0.05
546.4112549	0.75
547.7522583	0.21
549.8829956	0.20
551.0219116	1.92
551.8831787	0.13
564.9263306	0.47
566.0454102	0.08
567.0520630	0.42
567.7025757	0.07
568.5744019	0.08
575.0298462	0.17
576.4468994	0.18
585.5780640	0.06
593.3390503	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	611.1443
Annotation	Oxidized glutathione
Peak:m/z	Relative Intensity
174.9852448	0.15
176.9254456	0.48
179.0382385	3.03
184.1589355	0.06
185.2360535	0.09
192.0434875	0.87
193.2516632	0.08
197.0765381	0.23
198.0496979	0.19
201.0374756	0.19
203.2381287	0.11
209.1251373	0.16
210.0878601	4.69
212.8651276	0.68
214.1307983	0.08
215.0494080	0.12
226.1712036	0.18
242.2136841	0.45
251.8278046	0.12
254.1658630	15.75
255.3569031	0.11
260.2021484	0.09
263.1226501	0.05
272.1932983	38.71
286.1537476	0.97
288.1818237	5.09
304.1423340	16.22
306.1073914	100.00
320.0380859	0.52
338.0280151	38.94
353.0190430	0.13
360.2182617	0.07
435.9650269	0.05
436.9492188	0.06
464.0822754	1.41
482.1411133	33.42
482.8384399	0.05
496.1842041	0.06
574.9685059	0.86
593.2583618	18.77
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	469.1201
Annotation	Unknow
Peak:m/z	Relative Intensity
130.9533997	0.04
132.8780212	0.07
146.0626526	0.19
161.9928894	0.04
163.9814453	0.25
165.0442352	0.03
179.9791870	0.07
187.0046082	0.03
209.0755310	0.09
211.0599060	2.93
212.0985260	0.48
218.2971344	0.03
223.1083984	0.50
223.8232269	0.08
224.7843628	0.17
237.0384369	0.77
238.1207886	0.20
247.9645996	0.06
258.9136047	0.31
259.9901123	0.04
265.0600281	1.69
266.1130371	0.19
267.3488464	0.05
278.1049805	0.15
304.4132080	0.13
307.1348267	0.03
308.1959839	0.18
309.2542725	0.07
321.9044800	0.07
323.3657532	0.18
324.0687256	0.12
340.0660706	100.00
341.0361938	36.87
341.6945190	0.18
353.6386108	0.03
365.7390137	0.08
366.4555664	0.12
369.4335938	0.04
372.1813965	0.48
377.2260742	0.05
381.2876282	0.12
389.2990417	0.04
393.9947815	2.69
395.1821289	1.66
408.9732361	0.05
411.4154358	0.06
425.9545898	0.07
428.9380188	0.10
429.6908264	0.07
435.0865784	0.13
436.4780884	0.07
442.8741150	0.10
450.4072571	0.04
451.0659485	0.56
452.0072937	0.65
452.6379089	0.04
460.5882263	0.26
470.8617249	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	298.0962
Annotation	5'-Methylthioadenosine
Peak:m/z	Relative Intensity
96.9136810	1.07
130.0086212	0.20
135.9899597	100.00
136.7072754	0.17
145.0232544	4.25
162.9660492	7.73
165.9815826	0.11
167.9462280	0.06
173.0352020	0.35
182.2135925	0.13
190.8547363	0.10
204.5794067	0.16
213.2221985	0.12
238.2367249	0.23
252.0596313	0.27
254.3029175	0.29
279.3383179	0.25
280.0541077	0.69
280.8407593	0.09
289.1699829	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	268.0479
Annotation	Unknow
Peak:m/z	Relative Intensity
87.8493271	0.05
117.9484711	0.02
134.1032410	0.10
136.0462494	9.33
151.9656219	0.25
170.9291534	0.03
180.2429962	0.01
184.2985535	0.02
186.0210419	4.13
203.9847565	100.00
205.9716644	0.03
225.1880646	0.12
231.8386688	0.13
232.8025360	0.02
239.9390869	0.02
249.9051056	5.44
250.5924225	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	301.0554
Annotation	Fludiazepam
Peak:m/z	Relative Intensity
87.9967346	0.06
94.8813095	1.23
103.8369446	0.05
112.9131622	9.62
113.9552917	3.32
130.9120026	100.00
131.8715820	0.39
145.8176270	0.20
184.1425781	0.13
199.0426941	0.39
214.7636719	0.07
282.1109924	0.08
283.1443481	1.90
284.2276611	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	521.2026
Annotation	Acetylchapliatrin
Peak:m/z	Relative Intensity
161.2548676	0.56
194.1670227	0.09
209.1374664	0.11
233.0844879	0.05
242.5580139	0.10
247.3325195	0.29
283.2617798	0.10
285.2307739	0.11
289.0713806	0.15
304.1657715	0.14
306.2219238	0.09
315.3397217	0.10
317.2584839	0.12
319.3217163	0.05
329.2069092	100.00
333.2869263	0.07
334.4129639	0.07
341.4440918	0.20
352.3325806	0.35
357.1809692	0.17
359.0173340	60.02
359.7973022	0.06
363.5696411	0.22
366.3093262	0.12
371.2783813	0.13
374.4196777	0.17
375.2676392	0.06
386.8850708	0.15
389.2000122	0.09
390.5786743	0.14
392.2713013	0.05
393.4227295	0.11
394.3237915	0.14
398.5136108	0.14
400.8921509	0.27
403.2716064	0.08
408.6663208	0.07
412.5956421	0.11
413.5724487	0.06
419.0588989	0.27
423.2890625	0.07
425.1303711	0.36
430.3229980	0.10
437.2172241	0.04
438.6922607	0.26
440.3901367	0.05
446.8753052	0.21
453.1174316	0.15
456.3579102	1.04
457.4884644	0.46
459.0634766	0.13
460.3138428	0.07
462.3117676	0.08
463.2814941	0.12
472.1638184	0.04
474.8173828	0.29
475.4609375	0.03
476.3253784	0.07
477.3224487	0.19
484.9532471	0.59
486.3422852	0.36
490.1121216	0.13
491.0442505	0.56
494.0391846	0.17
500.6770020	0.22
502.5399780	1.41
503.3668823	0.18
503.9860840	0.10
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
96.8852005	0.13
100.9306641	5.88
106.5096588	0.80
112.9606552	17.06
114.7564240	0.26
116.7203522	0.19
118.9465485	14.97
124.9001312	3.06
128.8550873	0.52
130.9112549	6.15
142.9313049	20.31
148.8888550	3.25
160.9630432	19.10
178.9953461	100.00
199.1338959	0.36
209.2997742	0.12
220.9094238	0.12
224.9440002	0.45
245.3885803	0.13
267.0656738	0.16
280.6537476	0.56
281.2841797	0.70
322.8107910	0.20
323.4639893	0.45
324.0694580	0.34
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
274.9047241	2.89
290.8023071	4.61
358.8359985	1.22
374.6458130	4.84
420.5397949	0.33
442.5487061	13.73
458.4138184	22.20
459.0273438	1.08
480.9716797	0.66
486.4758911	1.79
526.4898071	100.00
527.2453003	3.53
528.7097778	7.84
531.1161499	1.58
532.7697144	1.31
542.5399780	93.40
543.1868286	0.64
557.2716675	0.85
558.3414917	4.76
568.6461792	0.65
574.6085815	1.60
587.3859863	1.10
588.5809326	44.48
604.3918457	0.75
607.9060059	0.38
610.4708862	97.24
611.1059570	2.26
614.1840210	1.12
630.4603271	4.62
634.8267822	0.99
646.6497803	0.51
647.7558594	1.46
648.6921997	20.34
671.9317017	1.52
677.3688354	0.42
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	304.9915
Annotation	Unknow
Peak:m/z	Relative Intensity
98.9849396	0.05
110.9700623	0.06
114.9752197	7.20
132.8904266	100.00
138.0101624	0.05
143.2790222	0.06
159.9558411	0.11
166.1417236	0.13
174.9926300	0.21
193.0093384	0.05
196.2481079	0.12
197.0973969	0.05
198.1695557	0.05
200.8354187	0.04
202.6373596	0.04
206.8847961	0.05
217.2350159	0.04
224.7207642	0.06
226.8796997	0.17
230.5435791	0.21
231.1635437	0.13
233.0466003	0.15
240.8789673	0.02
241.9948730	0.25
242.9829712	0.08
245.0030823	5.75
258.1521301	0.07
259.1209717	0.12
259.7381592	0.04
260.3414001	0.08
261.0830994	0.07
261.9822998	0.07
269.2133484	0.08
284.4426880	0.05
286.0518799	0.79
287.0645447	0.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	467.1063
Annotation	Unknow
Peak:m/z	Relative Intensity
136.9743347	0.03
142.8470154	0.02
162.8420105	0.02
175.1048889	0.03
179.0493317	0.03
185.1668854	0.03
197.1130981	0.09
209.0576782	0.06
210.2266083	0.05
236.2941284	0.01
239.1814117	0.04
254.1733704	0.76
263.0093994	0.07
272.1990356	15.03
285.6792603	0.09
302.9139099	0.08
304.2188721	2.84
306.2624512	0.01
313.3632202	0.02
319.9970703	0.53
331.2053528	0.03
338.0617676	100.00
338.8402710	0.01
344.9735107	0.01
357.5312500	0.02
359.4259033	0.01
362.8365173	0.02
371.3148499	0.01
379.5667419	0.02
387.3808899	0.05
390.9097900	0.02
405.1366577	0.02
407.3895569	0.02
409.1712952	0.04
420.0542908	0.05
421.4087524	0.07
422.2251892	0.03
423.1344910	0.09
425.0234680	0.06
428.8351135	0.13
431.0404358	0.14
433.1976013	0.21
439.3398438	0.04
446.3005371	0.04
447.6440125	0.03
448.4539490	0.05
449.2646484	0.07
450.2554016	0.02
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
95.03341675	0.41
106.9274139	0.54
110.902832	0.57
123.2496643	0.28
128.1081848	0.46
134.9915771	0.24
139.1045532	0.59
141.0259399	0.73
143.0846863	2.95
147.1141968	0.20
151.009964	1.36
153.90625	0.56
154.8062439	1.48
158.8625031	0.75
160.1499634	0.47
161.1277924	0.45
163.1322021	1.35
167.0514221	0.40
169.1197815	0.18
171.1298676	0.83
173.306366	0.71
177.0726929	0.30
179.1054688	0.81
180.9616699	0.28
183.0608215	1.34
188.1090698	0.79
192.5704346	0.18
193.2236633	0.30
195.0537872	1.42
196.740509	0.67
199.0652313	1.42
200.1157379	0.99
205.0823975	0.63
207.1167908	0.47
209.1393738	0.73
210.9343567	3.99
212.0161133	0.48
215.3572388	1.09
216.0981445	0.48
217.6543884	0.58
223.2061768	1.64
225.213562	3.40
227.1277161	0.87
233.2211609	0.51
235.2556152	0.65
237.1213379	2.08
238.0184021	0.42
241.0320435	0.20
247.2167053	0.26
250.9966431	2.08
252.161499	0.55
253.1695557	5.84
255.1254578	1.06
257.3041382	0.87
265.0405884	0.32
267.2850952	0.94
269.75177	0.87
270.7807007	0.50
275.1403198	20.14
275.7676392	0.61
279.1673279	0.51
280.8779297	0.51
282.5777283	0.30
283.2564392	1.90
291.0941467	0.79
293.2028809	100.00
294.280426	1.36
295.4769287	0.49
302.4140015	3.98
311.0707703	0.42
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	437.1481
Annotation	E-3174
Peak:m/z	Relative Intensity
129.9689026	0.75
162.0970001	0.05
176.5397644	0.01
178.9660950	0.47
183.0454254	0.01
195.9591064	0.01
225.2097931	0.02
233.1605225	0.08
245.2775879	0.02
275.0308533	0.03
287.4204712	0.05
290.0557861	0.01
291.2264099	0.09
297.9282837	0.04
308.0762939	100.00
308.6804504	0.31
334.4215393	0.03
348.2930908	0.01
361.9498291	0.04
363.1661377	0.06
391.2784729	0.14
392.3691711	0.03
393.5161438	0.01
401.2595215	0.03
406.2010193	0.04
417.7195129	0.03
419.2815552	0.06
420.6613770	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	517.14
Annotation	Scytonine
Peak:m/z	Relative Intensity
151.0797882	0.12
156.9717712	0.90
161.0418701	0.55
178.9056854	1.96
218.8929443	0.14
221.0019989	0.22
235.0610046	0.07
249.1644592	0.19
257.2693176	0.08
258.3010254	0.13
264.7000732	0.42
275.2251587	0.41
280.9498291	0.53
293.1956482	29.51
302.7121582	0.26
305.0153198	0.24
309.0366821	0.84
319.2499390	0.74
337.1484375	100.00
342.0695190	0.10
348.5552368	4.03
349.2715454	0.15
351.0045166	1.15
354.6923218	0.36
355.4171143	0.09
362.1459351	0.03
364.7492676	1.42
378.9868774	0.56
380.8698120	3.46
387.2483521	0.07
391.6340942	0.05
392.9674683	0.17
396.5867310	0.59
410.8462524	6.14
415.2899780	0.06
430.9829712	0.78
432.7863159	9.87
440.7299805	0.33
444.7808838	0.24
448.8271484	0.11
453.1412354	0.32
454.7472534	0.07
456.8719482	1.21
470.8762817	28.93
473.4332886	0.54
486.8297729	0.16
492.8080444	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	448.1927
Annotation	Unknow
Peak:m/z	Relative Intensity
131.7550659	0.10
133.0502625	0.19
133.9508972	0.11
147.9851074	0.10
205.1751404	0.13
216.0925903	1.25
230.1168518	1.16
232.1416626	0.39
233.2321167	1.01
240.2296448	0.08
242.0548706	0.40
243.2312012	0.22
246.8307800	0.19
251.1056213	0.07
259.1365662	100.00
260.0968018	2.28
260.8396606	0.26
272.0971069	0.17
275.1197205	0.13
277.1249695	8.62
277.7622070	0.06
279.1177979	0.08
284.1939392	57.16
285.2330933	0.13
296.9792480	0.21
299.0833130	0.10
301.1798706	74.27
302.1302185	10.75
314.6582031	0.11
316.0727539	0.20
317.1868286	0.47
318.5787964	2.99
319.2310791	42.48
320.2866211	0.78
329.2200317	0.31
332.5147705	0.24
342.1987610	0.19
344.2059326	0.19
345.5190430	0.40
353.8413086	0.07
360.3234863	0.22
362.6664429	0.83
363.3728333	0.99
367.1702271	0.06
369.9817200	0.06
376.0014954	0.25
385.1494141	4.76
386.0902405	0.61
388.2770386	11.32
389.2911072	0.74
390.8265076	0.20
394.6206055	0.48
395.3352661	0.09
402.2909546	5.83
404.3323975	0.92
406.2522278	65.83
407.3353577	1.43
411.3896484	0.52
413.1556091	7.35
414.0674133	0.50
430.2600403	74.80
431.3479309	18.40
432.3697510	0.09
437.2767029	0.06
438.5920715	0.35
439.5721130	0.80
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	485.2108
Annotation	Unknow
Peak:m/z	Relative Intensity
139.8454742	4.49
157.9433136	100.00
166.0035095	6.46
179.0840759	0.39
298.4016418	0.36
302.1165161	2.26
317.9772034	0.55
320.0678711	27.79
323.0211792	2.86
328.0887451	0.84
338.2140503	0.13
364.0925903	0.17
461.5255432	0.50
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	426.2872
Annotation	Prostaglandin E2 serinol amide
Peak:m/z	Relative Intensity
131.2001801	3.03
138.7900391	2.17
145.1356201	9.25
146.9678955	1.38
170.9852295	2.67
172.4921265	6.27
177.3773193	5.65
193.3175964	1.26
195.1738586	2.43
197.0184326	2.43
201.1108551	2.43
205.803894	3.28
226.3453369	6.76
231.2293549	2.82
241.2007751	3.69
247.2588196	2.65
254.2168579	1.27
262.8460083	4.40
268.3458862	2.83
269.2039795	2.89
270.0842285	3.60
271.212616	3.81
281.4974976	12.24
295.3017578	2.65
309.1369019	2.89
309.9610596	2.64
313.3509521	1.64
316.532196	1.25
317.4667358	3.68
323.1812134	3.59
328.4871521	3.48
335.0217285	2.14
339.3257446	10.59
349.4162903	5.29
354.0979309	6.49
357.1101074	5.06
363.1809998	1.25
366.2340698	2.69
377.2452393	4.34
378.1698914	3.96
381.3272095	4.53
385.5207214	1.85
390.6256409	23.72
392.1175232	4.74
395.9655457	3.68
398.499054	3.61
407.4785461	7.75
408.2732239	100.00
409.5096741	4.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	352.064
Annotation	Unknow
Peak:m/z	Relative Intensity
100.8931808	0.09
126.1143265	0.22
127.9959564	2.89
143.0431824	3.85
145.8896484	0.98
160.0738220	0.26
167.1143188	0.18
170.9308777	0.28
174.9829865	0.48
177.0901489	0.11
178.9495544	3.84
185.1005402	1.63
190.0965881	0.26
197.1367188	0.22
203.0555420	0.30
205.0670471	0.05
210.0745239	1.70
217.0064697	0.13
223.0714417	1.17
228.2532043	0.13
229.3128662	0.24
248.8266907	0.20
251.9214478	0.22
254.0682068	44.17
254.6856384	0.06
268.0359192	0.32
272.0987549	100.00
272.7125854	0.48
280.0165100	0.09
286.0728149	3.98
288.2758179	0.10
292.2043152	0.06
294.2025146	0.12
300.2516479	0.20
304.2144165	12.91
306.2245789	0.43
310.0318298	0.09
314.0278320	0.47
320.8209839	0.16
332.2304077	0.19
334.0766602	19.57
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	225.1118
Annotation	Myxostiol
Peak:m/z	Relative Intensity
78.9795761	0.10
94.9697571	0.18
98.8244782	0.19
104.8929443	0.36
109.2967224	0.09
111.0591125	0.06
112.8651428	0.08
118.9225311	0.12
123.4517670	0.08
127.6876068	0.08
128.7855682	0.04
130.9741516	0.08
138.1079712	0.06
143.1519623	0.08
146.9801025	0.52
148.9034576	0.13
154.9800568	0.18
161.2713470	0.44
163.1265717	3.00
164.8819733	0.39
167.1178131	0.52
169.1017914	0.23
171.1148376	0.09
179.0627899	1.79
183.2626190	0.87
184.0153656	0.77
188.9752045	1.30
190.9805756	0.20
192.9851227	0.37
195.1529236	0.19
197.2095032	0.20
204.7613525	0.07
206.8903961	100.00
207.8463135	1.23
223.5685577	0.05
224.9678192	2.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	422.0252
Annotation	Glucoiberin
Peak:m/z	Relative Intensity
128.9759521	0.38
130.9826050	0.01
132.0762329	0.00
134.9857941	0.02
139.0881042	0.25
140.1433105	0.02
145.1847076	0.13
152.1021423	0.00
153.1036377	0.01
158.8098450	0.01
161.9884491	0.56
163.0869293	0.12
164.1902161	0.05
165.2069702	0.01
166.1248474	0.01
167.0988159	0.02
168.7891388	0.02
180.1045227	0.58
181.0601044	0.06
182.9074402	0.01
190.0790710	0.01
191.2189636	0.01
192.0072937	0.01
195.0222473	0.61
196.0786591	0.75
197.1151123	0.07
198.0636292	0.04
199.0395660	0.02
207.6801758	0.01
211.0874939	0.03
212.1000671	0.02
222.1107788	0.01
223.3127289	0.02
224.1790466	0.04
226.0847168	0.23
227.2312012	0.30
229.0225677	0.32
230.0947723	0.01
231.1295013	0.02
241.0384216	0.11
242.2151184	0.04
244.1303711	0.77
245.2052307	0.04
259.1028137	5.90
260.1134949	0.49
260.9375305	0.01
270.4626770	0.01
273.1530762	0.05
274.1316833	0.08
275.1430054	2.02
276.1860046	0.15
278.1405640	0.09
279.1212158	0.01
289.0476379	0.00
290.1014099	0.02
291.1151428	1.23
292.1644287	0.12
303.1721802	0.00
315.3103638	0.01
324.4113770	0.02
328.1378784	0.01
329.1036377	0.01
331.1712646	0.04
332.5301514	0.01
342.1976929	1.10
343.2364502	0.28
358.0958557	100.00
359.0950928	9.98
361.1048279	0.02
377.0464172	0.01
388.0943909	0.01
404.1253662	0.01
407.0431824	2.22
408.1761475	0.35
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
180.8341827	1.07
196.8293762	19.19
197.8732605	0.23
198.6957092	1.66
200.7911072	1.09
206.2058105	0.20
207.1379395	0.31
214.8378906	2.57
217.0989685	0.10
219.1351624	2.83
220.1299133	0.76
223.0666809	8.47
237.7316589	0.46
245.1000061	0.11
246.4653931	0.36
258.0115662	0.09
290.8048706	100.00
306.8881226	2.69
313.2539368	0.42
315.3027954	0.80
356.0693665	0.23
357.1531677	0.66
378.5971069	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	426.2877
Annotation	Prostaglandin E2 serinol amide
Peak:m/z	Relative Intensity
145.0671387	4.58
153.0664215	1.60
159.7763367	7.44
160.9885712	9.56
163.1322174	8.69
169.4242706	5.32
171.1110077	6.55
187.311615	3.71
189.3010864	5.41
201.0455933	9.13
203.9146729	7.47
223.4037781	3.18
236.9560547	4.88
239.4207153	14.13
246.4025574	1.38
263.4640198	12.53
273.021698	8.60
281.1774902	6.57
282.3336487	5.80
291.8913574	6.58
294.2372437	6.27
295.3564148	2.86
301.3613281	20.14
304.2403564	3.71
307.6551819	8.82
309.4022827	3.29
311.1674805	3.31
312.1804199	3.65
313.3192749	7.76
314.2883301	15.82
327.1768188	3.13
329.0565796	1.16
332.3296509	5.83
334.1400757	3.01
338.4460449	4.14
339.4703979	11.68
341.2658081	8.13
353.0058594	25.06
357.3467407	3.63
362.0516663	2.53
363.3536377	15.30
367.5955505	2.23
374.0151672	2.46
377.0166016	5.35
379.3209534	2.44
380.3152161	18.88
381.4651184	3.28
385.1565247	4.78
385.785614	3.50
390.4676208	34.71
394.9533691	15.99
398.2789917	8.88
407.1673889	11.82
408.2784119	100.00
409.3848572	2.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	753.2239
Annotation	Sibiricose A4
Peak:m/z	Relative Intensity
214.0959778	0.02
215.1884308	0.14
217.0847015	0.11
218.0422974	0.05
220.9784851	0.08
223.1130371	3.64
227.1671143	0.05
229.0284729	0.07
230.0138245	0.20
231.0897217	0.20
232.1442719	0.53
233.0093842	0.07
235.1986389	0.07
245.0947571	0.27
246.1060028	0.29
247.1249542	1.79
248.1126404	0.02
249.7187042	0.04
258.9662476	0.34
261.1369934	0.80
263.2122498	0.16
265.0847168	0.39
272.0758667	0.06
274.1067810	0.25
275.2395325	0.13
277.2850342	0.57
287.2276001	0.24
289.2241211	7.39
295.1281128	0.25
298.3866577	0.02
303.3730774	0.03
305.1416016	0.27
307.4043274	0.07
309.1806335	0.04
313.1624756	0.02
316.3844604	0.02
319.1746521	0.04
323.1087646	0.16
325.0917053	0.11
331.2690430	0.72
349.2659912	0.21
353.3177490	0.02
358.3398438	0.05
367.2228394	0.15
371.1852417	0.04
384.9875488	0.28
399.2251587	0.02
427.2753906	0.64
455.5575562	0.03
457.0674438	0.51
457.6812134	0.01
467.4284058	0.07
469.0290527	0.14
469.6495361	0.03
475.0971680	0.02
487.1996460	0.54
493.3659668	0.06
511.2969971	0.46
515.2526245	0.85
529.2200928	100.00
529.8377075	0.12
536.1911011	0.12
547.2078247	0.29
693.0244751	0.23
707.2717896	0.08
721.4522705	0.04
735.0795288	0.23
738.5704956	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	385.1263
Annotation	Piperenol B
Peak:m/z	Relative Intensity
110.0030670	0.05
125.9764404	0.05
152.1841736	0.06
156.0897980	0.13
162.1600494	0.05
186.0045471	0.32
190.8678894	0.09
204.0451050	4.66
246.4487000	0.07
250.1298523	0.29
251.1489258	0.04
255.9769287	0.28
267.9662781	100.00
269.2062988	0.43
270.2636719	0.13
320.0976868	0.21
326.7222290	0.06
335.8740845	0.10
351.4501953	0.30
365.9835205	0.20
367.0926819	0.55
368.0728149	0.05
369.3340149	0.03
399.3297729	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	280.9924
Annotation	Unknow
Peak:m/z	Relative Intensity
80.9891663	0.06
96.6808548	0.24
125.1239777	0.20
135.0908508	0.13
149.1532440	0.15
151.1572876	0.18
154.0397491	0.09
163.1792603	0.50
196.9450989	0.19
208.9900818	0.18
213.0919800	0.14
226.0734863	0.26
237.0800781	0.60
239.1540833	0.69
239.9454346	0.30
241.8956299	100.00
242.5181580	0.12
247.3010254	0.38
255.1284790	0.20
258.0534058	0.08
259.8342896	16.57
262.2655029	0.39
263.1282959	0.26
264.2286987	0.47
265.0508728	1.90
266.0599976	0.10
274.0726013	0.44
283.1870728	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	288.9366
Annotation	Unknow
Peak:m/z	Relative Intensity
115.0018158	0.35
130.8534241	1.97
146.9849548	0.50
158.9784393	8.20
174.8780823	100.00
214.9105530	0.20
232.8559570	0.03
244.8943787	24.46
261.0148315	0.44
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	932.47
Annotation	Unknow
Peak:m/z	Relative Intensity
313.4011841	0.21
331.4296265	0.31
431.3955078	0.33
454.8360596	0.11
543.1718140	0.16
585.6322021	0.34
622.0432739	0.29
662.2767944	0.06
677.3644409	0.26
707.3240967	0.17
715.3928833	0.10
724.1044922	0.14
739.3580933	0.07
765.2085571	0.15
777.7666626	0.30
795.9153442	0.49
814.7980347	0.22
830.5131226	0.35
839.4031372	0.37
842.2391968	0.15
844.6879272	0.28
846.1080322	0.21
848.8651733	0.16
878.3551636	0.33
882.1016235	0.75
887.6212769	0.51
892.7722778	0.15
910.7764282	1.00
919.2786865	0.80
934.9528809	0.05
951.5540161	0.20
952.9885864	0.31
987.6283569	0.20
1004.3495480	0.09
1006.5679320	0.11
1016.1753540	0.43
1028.0122070	0.57
1033.7099610	0.70
1047.6794430	0.12
1060.5516360	0.06
1063.6644290	0.34
1064.4497070	0.18
1065.5468750	0.54
1066.1915280	0.86
1080.3730470	0.19
1090.8131100	0.88
1094.7755130	0.07
1101.7380370	0.14
1114.7382810	0.28
1118.9514160	0.74
1120.8341060	0.41
1124.1347660	1.24
1127.0766600	1.73
1127.9733890	0.08
1131.1252440	0.20
1133.2203370	36.33
1134.6425780	1.11
1137.7644040	0.69
1138.6647950	0.14
1141.2287600	0.20
1143.5404050	0.28
1151.6865230	0.36
1153.8048100	0.09
1159.8759770	0.45
1165.3852540	0.79
1167.9483640	0.23
1199.2762450	0.39
1202.3643800	1.08
1215.8681640	0.37
1223.9660640	0.79
1227.4747310	0.11
1229.8750000	0.13
1237.4488530	0.10
1292.9244380	0.07
1293.6099850	0.34
1302.0037840	0.69
1352.7615970	0.13
1369.6848140	0.99
1370.4628910	1.17
1398.4141850	0.27
1407.1918950	0.38
1443.8649900	0.37
1457.6694340	1.19
1458.3402100	0.15
1484.4281010	0.33
1487.1248780	0.44
1520.2271730	0.28
1591.7694090	0.10
1593.8967290	0.63
1708.1693120	1.04
1775.3726810	0.08
1786.2452390	0.31
1823.7635500	0.08
1903.9235840	0.10
1910.6920170	5.88
1911.8267820	5.93
1922.2492680	0.09
1927.2742920	10.51
1934.5079350	5.13
1953.1086430	0.07
1954.4449460	1.32
1956.2869870	0.16
1957.7341310	0.14
1959.3255620	0.07
1961.6907960	0.56
1965.6964110	0.37
1967.6477050	0.22
1971.7154540	0.10
1975.8321530	100.00
1981.4973140	0.75
1984.2872310	0.22
1988.8581540	0.07
1992.7381590	0.36
1997.9427490	0.49
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	332.1172
Annotation	Furametpyr
Peak:m/z	Relative Intensity
134.6902618	0.03
159.7842407	0.10
180.1390228	1.69
180.9313812	0.11
193.1846619	0.04
197.7812500	0.12
199.1687012	0.13
204.3106079	0.03
210.8809204	0.11
224.1686401	18.75
235.3648376	0.20
236.0873413	0.16
237.3078003	0.05
243.9870300	0.27
245.1561890	0.33
246.0217896	0.04
250.0531616	0.41
266.3115234	0.16
268.0553284	100.00
269.2859192	0.05
270.1696472	0.33
271.0128174	0.08
272.3912964	0.10
273.0596008	0.24
275.3118896	0.11
284.1635742	0.09
286.0438232	0.41
287.1814270	0.04
288.0167542	0.19
289.2851562	0.18
290.1531982	0.13
294.1751099	0.07
295.3883057	0.19
296.0054321	0.14
297.1503601	0.08
301.2263184	0.13
302.0818481	0.18
312.1193542	0.22
313.1949463	1.16
314.0890503	0.84
314.9813232	0.04
317.4181519	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	337.0926
Annotation	Veranisatin B
Peak:m/z	Relative Intensity
109.0441208	0.05
111.0965195	0.03
118.9853592	4.68
130.9780273	0.14
136.9496765	0.02
147.1079102	0.13
155.0834808	0.39
160.2367554	0.04
162.9595032	100.00
170.9817200	0.06
173.0349426	4.17
175.1659393	0.02
177.1776733	0.08
186.2611847	0.02
191.0473633	7.47
192.4126892	0.02
219.0902710	0.02
228.2784729	0.06
229.1589355	0.04
237.0028687	0.05
247.2524414	0.02
253.7468872	0.02
256.0778198	0.03
263.0055847	0.11
271.6027832	0.02
272.3087463	0.03
273.1824646	0.07
275.4745178	0.08
279.0380249	0.06
289.0567017	0.02
291.0744629	0.28
293.1742554	0.60
301.0742798	0.02
307.3450928	0.02
317.2650146	0.03
318.1837158	0.05
319.1979980	0.09
319.8731689	0.03
321.8892212	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	385.1504
Annotation	Icariside H1
Peak:m/z	Relative Intensity
112.6660309	0.10
118.9977264	0.18
135.0025635	2.85
137.0679169	0.03
147.0900269	0.08
159.5581055	0.03
161.0812378	1.13
179.1036987	24.57
184.9263763	0.09
189.1589050	0.07
193.0838013	0.13
196.4234314	0.06
198.0418396	0.05
203.1608429	2.07
204.9785309	0.18
207.2889862	0.11
215.4805603	0.06
219.1859436	0.16
221.0390167	1.07
223.0285187	100.00
233.2028503	0.63
236.6477356	0.11
243.1773682	0.06
245.0670471	0.06
247.0234070	0.54
248.8861389	0.04
251.0440063	0.15
255.1974182	0.23
257.1408081	0.14
259.3500977	0.05
263.1625061	0.06
265.0352783	1.66
277.3565674	0.38
280.6660767	0.14
287.4426270	0.02
289.0541382	0.21
295.0889893	1.29
299.1190796	0.03
323.3673706	0.05
325.1309509	2.60
327.4503784	0.20
338.1946106	0.11
339.1849670	0.20
341.0325623	0.40
343.0939331	0.03
353.1750183	0.06
355.3985291	0.07
365.2520142	0.04
365.9502563	0.17
367.1621399	0.33
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	426.2877
Annotation	Prostaglandin E2 serinol amide
Peak:m/z	Relative Intensity
123.0492477	5.44
138.102829	1.68
161.1039886	1.51
163.01828	2.03
167.0603333	3.06
176.1322632	2.19
194.9715576	10.07
200.0308228	2.73
207.1886292	4.75
213.3274078	2.02
221.2852325	1.85
224.2012634	4.13
226.3355255	1.32
244.1391602	5.70
245.0656433	3.43
252.1427612	15.71
261.2835388	6.17
263.2580566	8.09
265.0659485	4.62
268.1459961	7.62
272.2388611	6.65
275.1928711	5.11
281.2131042	12.55
282.3869019	2.55
283.4125366	2.73
292.1590576	4.16
295.3074951	6.20
297.2295532	2.24
300.9876099	6.26
303.9801941	8.33
318.4030457	2.62
319.4575195	20.40
324.2848206	7.04
328.5588989	5.01
334.2484131	2.18
336.2686157	12.46
339.2865601	3.34
345.4252014	10.37
354.598053	8.18
365.6445007	6.52
367.1383972	16.59
368.3661194	2.99
372.9186707	2.18
377.209259	4.57
381.2946472	4.04
382.1694641	3.78
383.1796265	6.92
390.088501	19.17
390.8922729	13.60
395.4078979	12.50
397.3170471	5.49
404.4200134	3.05
407.5340881	25.60
408.2723694	100.00
409.5600281	7.78
416.9743347	15.56
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	614.74
Annotation	Unknow
Peak:m/z	Relative Intensity
198.9597168	0.04
215.0490112	0.13
232.8936005	0.03
385.0665283	0.35
386.1019897	0.58
386.9219360	0.60
446.9231567	0.06
454.7769165	0.15
458.9281006	0.18
469.1465454	0.14
497.4318848	0.16
499.0258179	0.54
499.9500122	1.35
500.8245239	1.20
501.4313354	0.03
508.0426636	0.29
509.2125854	0.07
515.9231567	0.10
517.1968384	0.27
526.6697998	0.12
527.8428955	0.06
530.2213745	0.08
538.9093628	0.12
540.0994263	0.91
541.1755371	0.47
543.9431763	0.05
552.8601685	0.21
556.1157837	0.32
557.9935303	0.13
559.9673462	0.09
565.8316040	0.88
567.8551025	100.00
568.9498901	43.48
570.0485229	0.10
584.4537964	8.14
585.3102417	19.17
586.2913818	12.02
587.7686157	0.91
589.2542725	0.31
590.0583496	0.26
595.9461670	0.19
596.6478882	0.23
597.2526855	0.15
601.1076660	0.24
609.6336060	0.10
613.9047241	0.51
614.7594604	0.10
615.3809204	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	712.2189
Annotation	Unknow
Peak:m/z	Relative Intensity
223.0567474	0.05
272.3544312	0.11
358.2590332	0.17
369.0577393	0.08
382.0620117	0.21
384.1358032	17.39
385.1925049	4.08
418.2972412	0.08
428.6179199	0.07
456.4108887	0.09
477.9239502	0.21
502.2437134	2.54
502.8994141	24.49
503.9953003	3.16
525.4020386	0.04
546.9598999	100.00
548.0079956	18.45
583.3442383	0.09
633.9253540	0.09
652.2637329	0.06
666.3269653	0.14
680.3799438	0.22
689.9924927	0.15
694.4890747	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	391.283
Annotation	Di(ethylhexyl) phthalate
Peak:m/z	Relative Intensity
149.0255737	100.00
150.0229034	73.11
166.8241272	10.54
168.0212402	17.83
181.2030334	2.21
214.3573151	9.76
216.1137085	5.66
222.2090759	5.62
261.0311279	20.76
278.980072	44.59
279.9714661	49.65
287.8303528	3.98
301.3946533	11.93
302.7795715	23.38
304.7895813	17.63
308.1965942	4.22
345.8965454	5.25
346.7469788	3.97
351.0790405	12.22
363.7738647	4.73
372.3141785	6.26
373.9997864	3.22
375.3246155	13.73
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	535.47
Annotation	Unknow
Peak:m/z	Relative Intensity
163.0841980	0.11
170.0329590	0.12
200.7174835	0.08
201.3777618	0.08
212.6474609	0.07
226.9109650	0.33
250.2192383	0.09
261.3168335	0.25
263.8091125	0.12
298.0617065	0.24
309.5712280	0.04
311.8206787	0.24
339.3030396	0.07
369.3508911	0.08
373.2711792	0.47
385.2495117	0.36
396.4488525	0.08
397.0651855	0.20
402.1328125	0.08
406.2470093	0.33
409.7979126	0.05
415.1506958	0.05
419.5677490	0.11
427.1932373	0.05
428.4807129	0.06
430.3637695	0.19
454.4359131	0.19
470.3930054	0.17
471.1143188	0.33
473.0297241	0.23
481.6432495	0.13
485.8630981	0.09
490.6617432	0.14
491.3228149	0.09
496.6826782	0.43
508.1649780	0.38
517.3466187	0.09
518.1140747	0.05
518.8484497	0.34
519.8862915	0.34
526.2158203	0.08
527.2273560	0.92
554.0667114	0.22
557.1477661	0.05
566.9765015	0.07
583.0192261	0.08
586.8839722	6.29
587.7555542	0.20
597.7160034	0.49
599.8200073	1.87
614.5843506	6.26
615.2256470	1.79
616.1469116	0.06
631.6448364	0.48
632.8403931	0.47
636.2457886	0.21
637.3007202	0.24
641.1390991	1.68
642.2981567	0.32
644.0973511	1.03
647.6606445	0.23
666.4597778	0.41
667.6021729	0.32
671.6151123	0.40
678.1328735	0.12
679.1660767	0.30
684.1920776	0.99
695.9082031	0.43
704.5772705	0.10
714.4594116	0.14
716.5680542	6.78
717.2289429	1.75
718.5351562	0.17
726.5500488	0.16
732.2457275	0.50
738.5083618	0.41
752.4351196	0.10
753.6619263	0.64
758.8215332	0.14
773.9650269	0.41
774.6011353	0.11
777.9932251	0.24
779.2482910	0.10
782.1480103	5.12
783.0034790	0.32
793.8392944	0.13
794.7615356	0.14
874.4998169	0.09
907.5263062	0.12
923.6536255	0.04
1009.6535030	0.05
1023.3665160	0.26
1106.2890620	0.14
1588.9168700	0.21
1726.3160400	0.06
1758.2507320	0.35
1771.2076420	0.06
1798.9434810	0.11
1811.1258540	0.11
1848.4260250	0.07
1853.9139400	0.06
1859.4073490	1.39
1860.3172610	0.23
1861.1136470	0.05
1876.1724850	0.54
1884.0650630	0.44
1890.1945800	2.74
1891.2180180	0.07
1894.9031980	0.25
1902.7808840	0.06
1905.3553470	0.11
1909.0670170	0.44
1915.1116940	0.56
1916.0045170	0.07
1932.4166260	0.12
1933.5274660	0.09
1936.5628660	0.16
1938.0764160	0.40
1938.9639890	7.62
1939.7491460	6.02
1941.5140380	0.47
1944.0979000	0.17
1946.6727290	0.20
1947.6385500	0.21
1948.3824460	0.24
1949.9671630	24.09
1950.6246340	0.11
1952.8807370	0.05
1957.3385010	0.05
1958.9915770	0.07
1962.9066160	0.20
1966.9571530	0.60
1969.8013920	4.48
1972.3817140	0.75
1973.4022220	0.42
1975.0718990	0.80
1977.1071780	2.35
1983.8283690	1.79
1984.6495360	100.00
1985.4357910	0.41
1986.7625730	0.21
1989.6350100	0.27
1990.2362060	0.07
1991.5455320	0.84
1993.7674560	2.15
1994.4328610	0.22
1995.5255130	2.02
1996.3848880	1.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	245.0125
Annotation	Unknow
Peak:m/z	Relative Intensity
79.8719406	2.79
80.9200592	4.82
86.9135895	0.09
93.0019379	0.23
96.8868561	0.76
108.9503174	0.16
119.0548248	4.14
120.9930725	1.62
121.8108521	0.18
136.9275513	0.13
149.0290680	0.03
153.1191864	0.03
162.9505157	0.11
164.9649200	100.00
166.0478363	0.05
171.3616180	0.07
173.0898590	0.11
181.0303802	0.40
182.8751221	0.28
201.0544891	0.32
214.7048645	0.09
217.9079437	0.08
226.1262054	0.05
227.1599274	0.27
245.2042236	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	431.12
Annotation	3'-O-beta-Glucopyranosyl plumbagic acid
Peak:m/z	Relative Intensity
123.1712646	0.04
124.9322968	0.04
135.1809082	0.10
135.9274445	0.03
137.9740906	0.09
143.0282288	0.22
151.0187073	0.06
153.0413055	2.35
158.9745636	0.29
161.0561066	3.14
163.4095917	0.04
165.3570862	0.07
178.9823303	0.61
185.1246490	0.08
187.0636139	0.13
205.1331940	2.78
213.2805023	0.03
223.0682678	5.55
233.0514221	0.05
238.2407532	0.07
265.3054199	0.04
281.2908325	0.07
301.2357483	0.11
306.7851257	0.11
313.2692871	0.03
315.1393433	0.05
340.4265137	0.02
343.2988586	0.03
367.2772522	0.02
370.0920105	0.03
385.1531677	100.00
385.7560730	0.41
411.2488708	0.06
413.0825195	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	702.3152
Annotation	Unknow
Peak:m/z	Relative Intensity
211.1880493	0.05
228.2048645	0.07
244.2468262	0.02
245.9941711	0.01
291.2874451	0.03
294.2111511	0.02
321.8365479	0.02
344.3990479	0.02
379.2400513	0.03
388.4371338	0.03
425.6022339	0.01
435.5634155	0.02
465.4017334	0.02
472.4644165	0.02
499.8050537	0.04
519.4940186	0.02
529.5307007	0.03
536.3196411	0.04
540.3878784	0.01
544.5464478	0.02
555.3071899	0.09
578.9294434	0.10
580.0603638	0.23
587.1989136	0.03
591.7297363	0.06
601.5449829	0.09
607.3718872	0.05
610.3357544	0.02
612.6856079	0.32
621.2075806	0.09
622.9916382	0.04
626.3830566	0.07
627.5433350	0.89
628.2595825	0.03
629.7962036	0.07
634.8687134	0.71
635.6761475	0.01
636.6057739	0.71
640.5220337	0.33
641.3779907	0.03
643.3726807	0.06
644.0886841	0.28
647.2952881	0.15
649.6583862	4.71
650.7028198	0.15
658.6111450	32.54
659.5562134	1.13
660.4340820	0.07
661.3392944	0.02
662.5247192	0.11
663.1251831	0.08
665.4702148	0.20
666.3511963	0.04
671.5694580	2.64
672.5999146	0.40
679.2883301	0.02
680.5757446	100.00
682.3438110	0.05
683.3110352	0.02
684.2464600	0.14
687.6771851	0.15
792.3635864	0.02
809.2656860	0.02
810.1285400	0.01
814.5245972	0.13
825.3298340	0.01
850.1806030	0.03
859.6311646	0.02
880.2539673	0.04
882.3121948	0.05
922.5148926	0.02
966.3798828	0.05
996.8711548	0.13
997.5581055	0.01
1005.6000980	0.01
1022.6069340	0.01
1026.7391360	0.02
1041.4307860	0.06
1043.2574460	0.08
1043.9555660	0.03
1044.6070560	0.04
1050.0410160	0.05
1052.0495610	0.06
1057.5700680	0.10
1067.5451660	0.03
1084.2180180	0.04
1084.9321290	0.02
1085.6011960	0.03
1087.6102290	0.28
1088.4128420	0.15
1096.4938960	0.08
1097.5377200	0.18
1128.8156740	0.03
1133.3500980	0.10
1140.5950930	0.02
1154.5512700	0.04
1159.3710940	0.01
1184.8281250	0.02
1186.6936040	0.07
1197.2885740	0.05
1229.4490970	0.06
1230.0562740	0.04
1230.7849120	0.12
1273.7249760	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	470.104
Annotation	Unknow
Peak:m/z	Relative Intensity
159.0970459	0.06
162.0466919	7.33
189.0053101	0.03
202.9962311	0.03
219.8566895	0.02
255.1601257	0.07
265.1658630	0.03
281.3107910	0.02
307.5692444	0.14
311.2449646	0.02
323.9772339	100.00
324.6003113	0.52
352.4682617	0.07
365.1795349	0.03
379.6767883	0.04
385.2270203	0.03
387.4133301	0.01
394.1775513	0.11
405.6816406	0.06
418.9090271	0.06
429.4831848	0.05
434.3667603	0.14
439.9552917	0.04
452.2159119	0.13
453.1672974	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	531.1025
Annotation	Unknow
Peak:m/z	Relative Intensity
156.9043884	0.06
160.1217194	3.68
161.1325073	0.39
161.9855804	0.08
175.1970215	0.08
176.6438904	0.24
205.2394409	0.09
206.9636841	0.47
243.0354919	7.19
243.7181091	0.07
263.0146484	0.31
265.4933472	0.08
267.4254150	0.10
291.1315918	0.34
295.2581482	0.19
297.0900879	0.71
299.0781250	0.11
308.3749390	0.11
312.9274902	0.29
319.3856812	0.17
323.2630005	0.10
325.2377319	0.17
332.8806763	0.16
343.9981079	0.11
345.6931152	0.21
351.0683594	0.41
354.3425293	0.16
359.0434570	0.09
368.0960083	0.29
368.9807739	1.40
372.0518188	100.00
372.8660278	0.37
379.2840576	0.07
383.1782227	0.17
384.2445679	0.11
385.2117310	0.18
399.6096802	0.27
401.9574585	9.37
403.4177246	0.05
407.3233643	0.55
410.6931152	0.08
423.1307983	0.06
425.2988281	0.64
428.7157593	0.13
441.5878906	0.38
445.6793823	0.26
449.0482178	0.59
449.9706421	0.44
456.0794067	3.86
456.8120117	0.28
465.4976196	0.26
470.3212280	1.03
473.5803223	0.50
475.2843628	0.33
476.2078247	0.08
485.5810547	0.07
486.1860962	0.45
487.5668335	0.10
490.4572144	0.19
492.9882812	0.37
495.0106812	0.25
495.6119995	0.09
501.2821655	0.18
504.1969604	0.11
505.4406738	0.36
509.1044922	0.41
512.4743042	2.16
513.3934937	1.40
514.2109985	0.40
515.2108765	0.17
521.3930054	0.70
522.0115967	0.07
530.3174438	0.08
539.7340698	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	756.85
Annotation	Unknow
Peak:m/z	Relative Intensity
288.3848267	0.23
387.3853760	0.18
545.2814331	0.50
548.7887573	0.94
577.1079712	0.28
578.3164673	0.38
624.9349976	0.86
658.3231201	0.15
665.8634644	2.11
670.6947632	0.34
681.9223633	2.99
697.8909912	2.13
702.1815186	2.83
702.8723145	0.45
705.1943970	2.06
720.0488892	1.89
727.1680298	23.90
727.8441772	0.36
729.1309814	0.45
732.5882568	0.97
741.5314941	1.76
747.9932251	0.56
767.8301392	0.15
783.3072510	0.87
816.8330688	1.73
828.5526733	0.67
834.2627563	0.77
840.4218750	2.39
862.3843384	0.58
874.3056030	2.66
892.9478149	0.14
919.5722656	0.59
936.1298828	24.15
937.2717285	2.01
941.7798462	0.15
968.8562012	0.14
969.6320190	1.19
1039.7913820	0.33
1068.5351560	0.30
1198.7956540	0.88
1248.5408940	0.22
1382.8729250	0.67
1722.7481690	4.75
1771.6075440	1.12
1818.6654050	0.16
1825.3304440	0.19
1830.9416500	0.11
1832.0422360	0.22
1838.9881590	1.59
1839.8283690	0.19
1844.0091550	0.84
1847.5168460	0.19
1859.0183110	0.65
1861.8004150	0.24
1863.7884520	23.50
1877.8782960	0.72
1883.9459230	8.44
1897.1232910	1.63
1902.1009520	8.54
1905.6905520	1.25
1908.8284910	3.08
1910.0194090	0.30
1911.9133300	7.57
1929.6209720	0.40
1931.3853760	8.55
1936.6842040	8.56
1938.2814940	17.21
1939.6247560	0.40
1944.3673100	1.35
1945.7547610	100.00
1946.8040770	2.58
1948.0255130	49.93
1959.9398190	0.90
1963.6031490	0.23
1965.2725830	0.15
1971.5174560	0.14
1976.7360840	56.30
1977.7579350	78.91
1981.3498540	5.90
1982.9713130	10.14
1984.8160400	0.23
1985.9473880	0.50
1989.8272710	1.31
1992.0548100	0.90
1993.8065190	0.39
1995.0260010	0.25
1998.6302490	0.51
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	330.0862
Annotation	Unknow
Peak:m/z	Relative Intensity
101.0698471	0.02
113.1878281	0.17
118.9928665	0.12
127.9907227	0.09
130.1399841	0.03
130.9275970	0.02
132.8908997	0.13
143.0637512	0.04
145.0111694	0.07
145.9642639	1.31
147.0321045	0.63
149.9221649	100.00
176.7041626	0.06
179.0788879	0.75
201.6323242	0.05
216.0394592	0.03
265.1577759	0.05
267.2436829	0.02
312.1287537	0.09
313.5067139	0.02
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
235.0207520	0.75
252.8842163	0.37
290.8308411	0.76
316.1143799	1.26
332.7876587	0.52
334.9153442	1.30
340.0551758	2.58
358.6959839	3.85
360.6758423	0.20
381.3225708	0.55
415.0914917	19.88
420.1270752	0.72
420.9085693	0.52
426.1383667	1.16
426.7394409	6.13
431.0228271	0.71
442.7399902	7.22
458.9028320	2.68
461.2272949	1.16
479.1415405	1.17
488.5725098	3.06
495.9177856	0.37
496.8433838	1.02
507.9740601	3.39
510.6165161	100.00
511.6716919	2.09
526.5996094	6.76
535.3239136	1.01
548.1519165	4.50
548.9174194	22.51
551.9833984	1.77
572.0115967	4.04
576.6593628	1.77
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	626.69
Annotation	Unknow
Peak:m/z	Relative Intensity
250.9530945	0.13
290.6872559	0.96
355.2083130	0.57
374.1311646	0.14
387.0288086	0.17
392.8043823	0.14
412.6884155	0.44
413.9850464	0.09
418.7931519	0.19
451.9066772	0.35
452.8830566	1.35
458.5087280	20.09
465.3576660	0.35
482.7538452	0.35
490.7564087	0.32
506.8073120	0.14
520.4670410	2.86
523.6417847	0.84
528.1498413	0.27
541.0654297	0.71
542.6079712	100.00
558.8612061	0.18
566.7178345	0.83
572.6009521	0.73
579.8679810	3.02
580.6986694	1.96
584.2210083	0.18
603.2142944	1.25
609.9111938	0.48
626.7232056	0.78
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
102.8764038	0.60
108.8843918	0.36
113.0332336	0.82
118.586441	1.13
120.8669052	0.23
122.9622421	0.45
124.8199539	0.45
127.0501938	0.37
128.9219055	0.84
135.1077118	0.23
136.9411011	0.86
139.0896606	0.85
141.0052185	1.31
141.9482117	0.34
152.8484497	0.43
161.1242981	1.02
163.0864868	1.66
164.9630737	0.32
167.2775879	0.91
169.393219	0.64
171.2309875	0.24
175.0215454	1.09
177.0314484	1.11
179.0795746	0.99
181.1212616	1.20
183.2025757	0.88
187.0584717	0.54
193.2496948	0.75
196.3759155	1.34
197.3351898	1.58
205.3521729	1.18
209.3761292	2.20
211.0964355	2.19
215.1293335	1.09
221.0502319	1.58
223.168396	1.19
225.2691345	0.74
226.8382874	2.07
228.81073	1.27
229.4975891	0.59
235.3021851	1.67
243.3434143	0.43
247.3917847	0.92
249.0864868	0.30
251.1677246	1.60
253.1912842	3.06
254.2697144	1.21
257.1661377	0.50
258.2037354	0.45
265.114502	1.34
265.7227478	0.76
267.2194214	1.15
275.2508545	19.63
276.0061646	0.74
278.732666	1.07
282.9674377	2.66
289.9693604	0.98
291.4697876	0.43
293.2149048	100.00
294.1836548	0.39
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	705.1821
Annotation	Lactulose
Peak:m/z	Relative Intensity
239.0158234	0.11
272.6548462	0.09
281.0182495	0.40
291.1405945	0.08
322.9991455	0.04
358.2542114	0.09
363.0557861	4.88
381.1535034	7.86
382.3610229	0.18
453.0461426	0.72
453.7124023	0.17
490.4420166	0.10
507.4254150	0.11
525.1502075	17.61
525.7655640	0.25
533.0004883	1.32
533.6555176	2.67
543.2831421	100.00
544.3816528	0.71
582.5704956	0.05
585.3455200	0.05
615.3702393	2.54
645.3466187	1.14
686.4688110	0.17
687.4382935	0.77
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	452.2781
Annotation	PE(16:0/0:0)
Peak:m/z	Relative Intensity
140.0207367	0.11
153.0640411	0.13
196.0384979	2.11
209.3752136	0.01
214.1322632	1.36
255.2541809	100.00
255.8544312	0.33
283.3201904	0.17
284.4418335	0.07
391.3281250	0.28
406.8118591	0.01
408.0459595	0.04
409.3266296	0.02
416.1056519	0.01
433.7230835	0.01
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
207.1051941	0.46
307.4705200	0.08
341.1345825	100.00
369.2970886	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	439.0549
Annotation	Unknow
Peak:m/z	Relative Intensity
124.9491806	0.11
138.9481812	1.06
142.8589478	0.05
150.8752441	0.28
163.0030212	0.09
164.9908142	0.40
169.0522156	0.36
179.0459900	0.04
181.1695862	0.04
182.0117188	0.17
197.1655273	1.14
215.2386780	0.08
223.1045837	1.76
240.9943848	100.00
242.1397095	0.15
272.1965332	0.29
275.1967773	0.10
276.7913513	0.13
279.1787415	0.08
281.9492798	0.13
289.3441772	0.08
301.1387939	0.14
308.1591797	0.11
334.7225342	0.13
350.3071289	0.03
355.6335449	0.23
373.9831848	0.07
375.0716858	0.22
376.4299927	0.09
381.5716248	0.08
386.4744568	0.11
392.5394592	0.08
394.4326477	0.06
395.1247253	0.32
404.1692200	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	310.018
Annotation	Unknow
Peak:m/z	Relative Intensity
129.0259247	0.06
141.1453247	0.03
159.0498352	0.12
162.9188843	0.02
165.1753235	0.02
182.0509338	0.01
189.0111237	0.04
190.9394684	0.04
200.0513611	0.11
203.9911194	0.04
207.0943298	0.05
209.0607300	100.00
210.1010437	0.06
210.9581299	0.07
211.8885193	0.07
216.2795410	0.02
219.2080688	0.02
219.9320984	0.06
230.1922607	0.03
232.7059937	0.02
237.0494690	0.02
246.0510864	0.02
246.9057617	0.02
248.0553284	0.24
260.1231079	0.39
260.8213501	0.02
262.9484558	0.12
265.1098633	0.03
265.9053955	0.12
280.9409485	0.04
281.9135742	0.03
291.8689880	0.34
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	538.67
Annotation	Unknow
Peak:m/z	Relative Intensity
175.1218567	0.17
212.9343567	0.33
215.9306183	0.05
232.2018433	0.20
290.8788147	0.33
314.8647461	0.06
339.1002197	0.20
342.0087280	0.15
346.2318115	0.18
348.9580688	0.14
350.9050293	0.05
364.1203003	5.81
364.7714233	0.24
365.4757080	0.05
369.8983765	0.18
370.9689941	0.43
374.6212769	0.45
381.7953491	0.12
383.7256470	0.10
385.8351440	0.24
386.8932495	0.63
400.1203613	0.05
402.1764526	11.69
403.2171021	1.67
406.0581055	0.03
408.9699707	0.13
411.2800903	0.06
418.2409668	0.38
452.0569458	0.23
454.6991577	100.00
455.3453369	0.33
456.5876465	0.07
470.7217407	7.36
474.9576416	0.31
478.3552856	0.09
491.9240112	0.41
496.5603027	0.05
508.4027100	0.57
514.7971802	0.17
520.0070801	15.38
521.1043091	1.70
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	465.0706
Annotation	Unknow
Peak:m/z	Relative Intensity
240.9675446	0.35
283.1212463	1.69
300.0477295	0.29
304.0845337	0.43
326.7316895	2.34
372.2166138	0.23
376.0181580	0.73
379.1175842	40.85
380.1476135	1.73
387.1071472	0.13
417.4013062	0.24
419.2720642	0.21
421.2246399	100.00
429.2228088	0.92
447.0108948	1.57
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	227.9822
Annotation	Unknow
Peak:m/z	Relative Intensity
85.1720581	0.07
86.8609467	0.08
97.8759613	0.10
100.0019531	0.15
109.0506134	0.13
133.2225189	0.05
165.0875397	0.04
165.7350311	0.14
183.3084412	0.11
186.9329376	100.00
192.6077118	0.14
193.3825684	0.07
194.6143036	0.06
197.2034454	0.07
204.2520447	0.79
204.8715515	0.98
207.8352356	0.16
209.3220673	0.10
210.1202545	0.33
210.8470306	0.23
216.3336792	0.09
227.7482758	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	348.0694
Annotation	dGMP
Peak:m/z	Relative Intensity
108.9670410	0.05
118.9722900	5.37
135.9356995	100.00
137.1423340	0.05
169.9932556	0.14
192.0529175	0.21
198.8063660	0.20
201.1251831	0.38
216.1644592	0.83
232.1668091	0.23
250.1585388	0.75
257.9297485	0.14
294.2909546	0.10
302.1392517	0.30
329.1196899	0.14
330.2606201	0.57
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	533.0637
Annotation	Unknow
Peak:m/z	Relative Intensity
174.1643066	0.05
180.9655457	0.03
195.2195129	0.08
200.5487061	0.02
207.1977539	0.12
208.2176208	0.03
209.9329529	0.74
210.6197510	0.02
225.0587769	0.05
239.4396667	0.06
245.0144196	0.17
248.0108032	0.06
263.0659485	0.06
264.1971436	0.08
266.2172852	0.03
273.9557495	0.21
275.0101318	2.49
283.3097534	0.03
287.0351257	0.18
300.8817749	0.12
307.5863647	0.31
308.2720947	0.16
317.8850098	0.07
328.4694214	0.06
329.1148682	0.49
335.2229614	0.06
339.1414185	22.95
340.3770752	0.14
349.0941772	0.04
369.0623779	0.08
370.3590088	0.21
371.5153198	0.02
374.1931152	0.18
383.3089600	0.13
401.1215210	0.07
403.9806519	100.00
404.5949097	0.32
414.0438843	0.18
418.5346680	0.03
419.4049683	0.08
420.4162598	0.19
425.1584473	0.07
427.0888062	0.03
428.1976929	0.06
429.9855957	0.04
435.5623779	0.11
440.2239990	0.04
451.7320557	0.24
455.3215942	0.03
458.0323486	1.89
464.4120483	0.03
465.3580933	0.03
468.9390259	0.06
471.8999634	0.20
474.0061646	0.14
482.2727661	0.11
483.4387817	0.03
487.1083374	0.07
487.8094482	0.03
491.6406860	0.06
496.5499878	0.30
499.7673340	0.07
502.8694458	0.16
506.4089966	0.12
507.4448853	0.13
514.5454712	0.91
516.2039185	0.37
524.6607056	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	473.1664
Annotation	Coelovirin A
Peak:m/z	Relative Intensity
148.9665527	0.06
161.1291199	0.33
178.9826050	0.48
184.9390869	0.05
191.0173492	0.08
199.1116638	0.05
204.9841766	0.56
217.1094208	0.38
223.2704468	0.08
231.1153259	0.24
246.8148499	0.25
249.1542358	7.37
250.1288452	0.65
251.2449341	0.08
265.2216797	0.56
267.1196899	85.72
273.1956177	0.17
293.0555420	0.22
297.4988098	1.28
298.2315674	1.00
305.1636963	0.22
308.9642944	0.26
311.3144531	0.58
313.2822876	0.10
319.1662903	0.05
326.2008667	0.14
341.0830688	0.11
345.0888977	0.18
363.8895874	0.07
367.0797119	0.06
377.4422607	0.05
385.1816101	0.42
387.3623962	1.93
389.2652893	0.15
391.1595459	0.11
395.4538879	0.16
401.2257385	0.08
408.2527161	0.12
411.1778870	0.36
413.1563416	0.87
413.9391174	0.10
415.0875244	0.06
425.1931458	0.07
427.2425537	1.51
428.0244446	0.29
429.2342834	100.00
429.9466248	0.36
431.2925415	0.60
433.2156067	0.11
435.0067444	0.82
435.9146729	0.11
436.7632141	0.05
437.3999939	1.04
446.3362427	0.18
453.2580872	0.06
455.0175476	1.57
455.7500610	1.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	262.0568
Annotation	Ascorbalamic acid
Peak:m/z	Relative Intensity
74.9572372	0.09
78.0727615	0.07
80.8440857	0.08
85.0052185	0.14
95.9997253	21.92
98.0569382	0.69
98.8504791	0.06
101.1089020	0.19
107.8217316	0.04
110.0730743	0.07
111.9803467	0.15
114.3307190	0.05
116.1076965	0.42
117.0206757	0.04
122.1154022	0.07
125.9997253	0.49
128.0648956	7.15
128.9968262	0.92
135.1413116	0.11
137.9735565	3.61
139.1074829	0.32
140.0410156	1.38
141.9521027	48.97
144.0991821	0.19
146.1251678	0.27
147.1274872	0.16
156.0560303	3.42
158.0102539	93.10
158.9394684	0.37
163.8128662	0.09
169.8551788	0.21
172.0415649	6.06
174.1393890	0.74
175.1042328	0.57
181.9259186	1.02
183.3327179	0.09
183.9565582	0.15
187.9980927	1.74
195.8954926	0.14
199.9814758	12.64
201.1779633	3.37
202.0160828	100.00
214.2524109	0.06
217.9453430	21.72
219.0749207	4.05
232.3297882	0.07
244.1188354	4.91
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
114.8901215	0.09
176.9748840	0.17
179.0142670	0.10
279.5463257	0.10
289.2822266	0.08
303.6955566	0.15
309.3104553	0.21
310.3638916	0.04
313.9900818	0.14
331.9733276	0.22
344.3179932	0.05
347.8915710	1.81
357.8594360	0.40
375.8191833	0.38
394.0481873	100.00
401.2563171	0.17
402.2263794	0.09
419.3345642	0.77
420.0989075	0.95
428.3171692	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	331.1135
Annotation	Mannopine
Peak:m/z	Relative Intensity
92.9467545	0.03
107.8986053	0.26
108.8984070	0.21
110.0928345	0.46
117.9220276	0.24
128.1398010	0.02
136.2181702	1.41
137.0390015	2.30
153.9920654	100.00
154.8202515	0.05
161.3825989	0.02
176.0763245	2.80
192.1338501	0.03
194.0534668	3.15
215.1408386	0.02
216.2771301	0.10
238.0861206	0.16
249.1471558	0.03
284.1865540	0.04
286.4097290	0.05
300.2235107	0.02
312.2457275	0.02
313.3374634	0.35
314.1226196	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	271.2281
Annotation	2-hydroxyhexadecanoic acid
Peak:m/z	Relative Intensity
92.93849182	0.06
96.80528259	0.05
112.8363037	0.03
121.0760803	0.05
125.0125122	0.03
129.2155762	0.03
129.9033661	0.05
143.0195618	0.02
157.0122833	0.09
159.1868744	0.03
169.2101898	0.01
183.0584869	0.03
185.1546478	0.04
187.1790314	0.06
191.2833099	0.18
193.1117096	0.04
197.0259552	0.04
206.9878235	0.03
207.6365509	0.06
209.1766815	0.23
211.2779694	0.19
213.0897369	0.19
223.294342	0.43
225.2212067	100.00
227.083786	0.96
227.8442841	0.07
228.9835052	0.16
235.256958	0.05
237.2019806	0.04
240.16008	0.03
241.0331879	0.07
243.0753326	0.24
251.2861176	0.11
253.2052765	4.86
255.230835	0.56
256.1560669	0.04
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
108.8406754	0.02
112.8257599	0.22
119.1978149	0.01
127.0473251	0.02
129.0811005	0.06
135.1127930	0.20
139.2251740	0.03
141.0351715	0.06
145.3168335	0.06
153.4368896	0.04
156.9830017	0.10
159.0339355	0.02
170.9668274	0.02
175.0938873	0.09
181.1271973	0.03
189.2532806	0.04
191.0755615	0.18
193.0495300	0.16
196.3110046	0.07
205.0490723	0.31
207.2571716	0.03
211.3575592	0.04
223.1500244	0.36
230.9849243	0.11
233.3010864	0.02
240.5393066	0.03
244.8954163	0.03
247.1619263	0.11
249.1448059	8.84
264.3567505	0.03
265.3583984	0.08
267.0817566	100.00
271.2186279	0.02
272.8130493	0.05
289.0609741	0.04
290.1733398	0.01
295.0742493	0.03
296.1347656	0.01
297.3471069	0.33
301.2450256	0.07
304.3699646	0.05
305.4534302	0.04
306.6787109	0.02
309.2822876	0.01
311.0396729	0.02
321.7420044	0.01
325.1207275	0.04
327.1687012	0.03
331.2848816	0.04
338.3125000	0.12
339.1237793	0.57
339.7606201	0.01
341.4837952	0.09
342.2595215	0.05
346.1291809	0.05
351.3185730	0.02
354.2679138	0.03
355.5278931	0.08
357.1098328	0.04
365.4207458	0.01
366.6303711	0.20
367.3056641	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	150.0229
Annotation	S-Methyl-L-cysteine sulfoxide
Peak:m/z	Relative Intensity
62.8066826	100.00
72.9076843	0.06
76.9264145	0.19
77.8615418	0.07
79.9390869	0.26
85.9177628	12.69
103.9554596	0.30
132.9236298	20.36
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	607.2543
Annotation	Phaeophorbide b
Peak:m/z	Relative Intensity
203.9186707	0.09
210.9184418	0.19
219.3601227	0.07
225.2600098	0.14
236.0954742	0.14
241.2970276	0.08
241.9140625	0.12
260.5863342	0.06
263.1945190	0.28
265.4780884	0.09
279.2849121	0.05
281.4421997	0.13
282.9692383	0.10
284.0994263	0.15
291.0087280	0.07
293.1934204	0.12
295.4616699	0.06
299.1362305	0.07
302.4420166	0.07
303.3422546	0.08
309.6719971	0.09
311.2121887	0.16
323.3287964	0.04
327.2487793	0.37
333.1727295	0.17
335.2395630	0.33
340.9049072	0.22
345.5831299	0.06
351.6587524	0.05
367.5613403	0.12
369.4187622	0.13
374.6498413	0.27
381.5512085	0.08
391.8063965	0.15
394.0681763	0.26
399.2290649	0.04
402.0869141	0.08
403.3323975	0.06
419.5104370	0.05
423.0993652	0.20
425.4403687	0.11
429.3544922	0.05
433.0416260	0.15
437.2832642	0.08
437.9899292	0.10
441.4664307	0.08
442.4617310	0.41
446.4275513	0.07
447.8370972	0.19
452.0946655	0.08
454.7373047	0.17
455.5413208	0.24
459.5085449	0.24
460.5235596	0.15
461.4462891	0.10
462.4612427	0.50
473.3988037	1.60
474.3264160	0.85
475.4171753	0.37
476.4639282	0.95
487.3248901	3.44
488.4910889	0.62
490.5437012	0.35
491.2723389	0.32
492.2254639	0.10
493.2030029	0.14
501.4577637	1.15
502.4075317	0.34
503.2976685	0.23
504.7665405	0.43
505.4524536	0.57
506.2355957	0.92
507.4307861	0.06
509.5764771	0.45
511.1801147	0.09
513.2657471	0.10
514.3079224	0.12
515.4283447	0.42
517.5049438	0.60
519.3893433	15.58
520.3727417	4.89
521.4343262	0.50
523.6188354	0.23
525.5958252	0.14
529.1906128	3.32
530.2783203	1.20
531.4213867	0.43
533.3210449	3.12
534.3731689	4.06
535.4312744	0.15
539.3945312	0.22
543.3281250	0.55
544.5322876	0.13
546.2697754	2.85
547.3639526	100.00
548.4144897	22.37
549.4450073	0.17
551.4438477	0.56
552.8082886	0.22
554.5162354	0.17
555.2239990	0.08
557.3384399	0.81
558.4563599	0.09
560.4811401	0.86
561.4760132	2.74
562.4081421	1.53
563.5372925	0.94
564.3596802	0.38
565.4627686	0.42
566.3535767	0.52
570.4605103	0.96
571.1998291	0.46
573.5963135	0.04
574.2654419	3.22
575.3131714	5.57
576.3598022	1.12
577.5282593	0.11
579.3843994	97.60
580.4873657	21.27
588.5103149	1.97
589.3605957	6.64
590.2436523	1.11
601.0424194	0.09
606.6450806	0.20
608.2368164	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	614.9
Annotation	Unknow
Peak:m/z	Relative Intensity
198.9579468	0.10
217.2446594	0.03
229.1104889	0.13
245.0520630	0.02
272.9889526	7.43
289.1787415	0.01
385.2709961	0.03
387.0372314	18.08
402.6305542	0.03
443.1734619	0.01
458.9859009	0.22
460.9354248	0.17
465.1827393	0.01
468.9421387	0.02
471.4375610	0.02
473.1369629	0.11
474.9873657	0.03
481.0520630	0.04
485.3328247	0.01
490.5913086	0.03
495.9240112	0.02
499.2434082	0.41
500.8723145	100.00
501.5227661	0.42
512.8181763	0.07
513.9688110	0.02
514.9946289	0.05
524.1362305	0.02
526.9410400	0.07
540.0214844	0.03
541.0328979	0.10
568.7645264	0.11
570.9021606	0.26
571.8953247	0.09
581.9905396	0.01
614.9734497	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.0876
Annotation	Grevilloside F
Peak:m/z	Relative Intensity
97.9971542	0.28
117.1776428	0.21
118.8276596	0.12
129.0275574	0.15
131.3903046	0.07
132.2133484	0.04
133.1177673	0.59
135.0286255	6.82
142.8728638	0.06
152.8215027	0.04
160.9851074	25.86
175.1796722	0.04
177.1437225	0.21
178.9855652	100.00
201.0110168	0.24
203.0242310	7.11
209.2445068	0.13
210.2804565	0.03
219.3993835	0.07
221.1203003	1.32
223.3066711	0.06
233.1361694	1.40
235.1691895	0.07
243.3734741	0.04
245.2757568	0.33
250.4572754	0.05
251.0869141	2.32
253.2620850	0.07
260.3678589	0.28
261.1755371	0.25
281.1515808	4.54
293.2711792	0.04
294.1650696	0.21
295.0103455	0.86
297.0280762	0.19
298.4340820	0.24
304.8976135	0.06
309.9046021	0.14
311.2647400	0.06
313.2498779	0.31
320.9147339	0.05
323.1927795	0.83
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	191.0196
Annotation	Diketogulonic acid
Peak:m/z	Relative Intensity
84.9709930	0.18
86.8735275	1.27
110.8589630	100.00
111.7152863	0.06
128.9743500	2.52
130.8639832	1.21
146.9791412	0.12
154.9313965	0.34
172.8429108	23.62
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	446.1791
Annotation	Unknow
Peak:m/z	Relative Intensity
128.0347290	0.14
145.1914978	0.04
147.9919281	0.38
169.2200317	0.10
172.8909912	0.03
180.1155090	0.10
189.0372620	0.08
195.0241089	0.07
203.2130280	0.15
204.2019958	0.13
205.1013184	0.43
211.0318451	0.14
223.0458984	0.04
224.0543823	0.14
233.2848206	0.05
241.2858887	0.46
241.9938049	0.58
245.9653625	0.04
248.0211487	0.13
251.2110596	0.06
254.0668945	0.03
255.8590393	0.03
258.1831360	0.18
259.0830078	1.37
265.1401978	0.11
267.2536011	0.03
269.0851135	0.12
275.0448914	3.88
277.2647705	0.16
285.1846924	0.03
291.0551758	0.12
300.1414490	1.10
314.0505066	0.07
317.2572327	16.76
331.3554382	0.03
343.2556458	0.03
355.6529846	0.04
359.0053711	0.03
360.3189697	0.49
361.3064575	0.13
366.9707947	0.08
369.3110657	0.27
372.4266968	0.06
373.8479919	0.03
382.2323303	0.04
384.3016663	0.04
385.2716980	0.27
386.1877136	1.01
387.2297668	6.05
388.3126526	0.13
400.4047241	0.08
402.3776855	0.48
404.2553101	100.00
404.9165955	0.53
410.5923767	0.06
411.2854919	0.72
428.2237244	6.63
429.3060303	25.90
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	959.2826
Annotation	1,2,2'-Trisinapoylgentiobioside
Peak:m/z	Relative Intensity
273.9609680	0.05
276.8764038	0.19
278.2103577	0.03
281.3343201	0.09
286.9118652	0.20
289.1641846	3.77
290.1948853	0.74
295.6040649	0.21
296.2612000	0.26
305.3635254	0.07
307.2586975	0.07
308.3048401	0.18
313.1429749	0.06
325.2396240	0.23
331.0816956	0.68
332.1746216	0.08
337.2500000	0.03
341.2608948	0.06
349.0381165	0.07
367.2046509	0.97
368.3092651	0.21
370.4399719	0.09
385.1925049	0.62
386.1785889	0.31
395.2738647	0.08
399.3989868	0.10
425.2094116	0.06
427.1307373	3.99
428.1279297	0.88
439.4880981	0.06
440.2022095	0.13
451.3799438	0.04
452.1618042	0.02
453.4661255	0.07
454.3854370	0.04
457.2785645	1.58
458.0187988	0.71
469.1600342	3.47
470.1716309	0.72
473.1854248	0.18
485.2947998	0.04
487.2801514	1.52
488.3428345	0.31
494.4564209	0.16
495.6206055	0.06
497.1681519	0.47
498.3126221	0.36
511.2181396	11.48
512.2276611	2.51
512.8555908	0.04
515.2401733	0.52
529.2317505	10.81
530.2863770	3.27
532.2464600	0.11
547.2239380	0.03
590.9791260	0.08
629.3117065	0.09
633.2684326	0.16
634.4091187	0.18
645.2056274	0.03
651.6592407	0.06
653.1161499	0.07
657.5357056	0.07
663.3643799	0.64
672.1350708	0.05
673.6520996	0.05
675.0040894	0.61
679.2916870	0.18
681.3703003	0.03
683.1976929	0.07
686.3987427	0.08
693.3235474	1.30
694.1890869	0.09
700.3009644	0.20
715.4741211	0.15
717.3090210	1.78
718.3335571	0.24
720.3659058	0.12
721.2203979	0.46
722.4949341	0.21
730.5484619	0.10
735.2286987	100.00
736.2304077	30.73
736.8470459	0.16
742.2897949	0.06
744.7980347	0.22
749.4054565	0.06
753.0444946	2.65
754.2922974	1.12
765.2557373	0.02
770.8854370	0.02
787.6369019	0.03
794.4354858	0.19
802.8142700	0.14
808.4334717	0.12
830.3792725	0.06
832.9129028	0.03
835.3087158	0.12
837.2698364	0.09
845.4402466	0.04
847.2634277	0.15
853.6611938	0.06
854.4181519	0.17
859.4590454	0.03
872.7903442	0.09
879.1237183	0.03
881.2766113	0.11
890.2984009	0.19
895.2111206	0.04
897.4309692	0.31
898.8319092	0.02
900.4161377	0.23
914.2424316	0.03
916.3606567	0.15
923.9855347	0.16
927.2636108	0.09
941.3623657	0.07
942.1540527	0.11
942.7717896	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	336.15
Annotation	Unknow
Peak:m/z	Relative Intensity
109.9620819	0.77
111.1895065	0.04
131.8491058	0.19
135.5402679	0.09
138.0032349	0.44
145.8776855	0.04
156.0404663	1.48
160.0268402	0.44
162.1917419	0.27
162.8072968	0.14
171.1923676	0.22
174.0072479	0.48
187.9618225	0.22
190.0449829	0.12
192.0812073	0.82
193.7075653	0.19
197.0805359	0.28
206.0698242	0.48
207.2321320	0.10
218.0520935	0.11
220.9087830	0.07
228.3096619	0.07
229.1998291	0.12
244.0068359	0.47
246.9734192	0.06
253.8287048	0.38
255.5871582	0.74
256.2729187	0.69
257.0879822	0.04
267.5427856	0.16
269.0933228	0.10
270.0218506	0.30
272.1266174	5.68
274.3613892	0.58
276.0148315	0.09
281.3047485	0.08
286.3859558	0.07
287.1864624	0.60
290.1256104	21.86
290.9426270	0.09
292.0581055	0.18
294.0907288	0.04
295.3231506	0.21
300.1672668	5.33
301.1141357	0.04
308.2973022	0.05
309.1007080	0.31
313.3243408	0.10
318.1171265	100.00
326.9008179	0.40
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
83.05487823	0.76
95.13656616	2.99
104.655838	1.89
106.1141663	0.99
108.9755096	1.66
112.8604279	4.77
125.039093	2.39
128.9408112	8.91
135.2192841	0.99
138.8498993	2.64
141.0289154	3.59
147.8088684	4.84
150.9461212	100.00
152.181015	4.67
152.9682465	2.48
154.0191498	3.29
160.917984	1.37
166.1339874	0.61
167.0655518	6.48
169.116745	3.36
171.1674194	3.38
175.0254974	1.90
179.0180206	5.80
180.1667786	1.08
181.2388763	1.29
183.4116974	5.65
185.2330933	5.12
189.0535126	1.29
190.0258026	1.51
191.0484924	1.29
192.2464752	1.14
194.1616211	2.13
194.9680023	1.64
195.9622345	1.51
197.2352448	3.37
198.0136108	1.06
207.2931519	4.40
208.7990265	2.09
211.1905365	11.09
212.1937256	0.84
217.0211487	7.68
221.2918243	3.44
222.1925964	3.66
223.0659943	0.69
223.9644318	0.91
225.2062531	9.57
225.8516235	4.16
231.7113037	6.95
234.2560883	2.52
235.1818695	52.46
235.9628906	1.49
238.1483307	21.99
239.2436676	2.39
251.2251129	1.12
253.087265	66.83
254.0902252	9.33
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0853
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
91.00231171	0.08
94.98136902	0.07
95.68251038	0.09
101.0209961	0.06
103.0221863	0.09
115.1306915	0.04
119.1395264	0.02
128.987915	1.40
129.9694214	0.16
133.1073151	0.15
134.782959	0.05
140.8654633	0.07
142.1271515	0.05
144.8999329	0.10
151.0451202	11.50
152.0334625	2.05
153.2401276	0.15
154.1312103	0.14
155.0362396	0.08
157.1261749	0.51
165.289505	0.08
166.0451965	0.12
167.0384064	0.38
167.8302917	0.05
169.1356964	0.14
170.1257782	0.18
170.9860992	0.21
179.0054779	0.48
180.9638672	0.06
182.0490265	0.11
182.9960785	0.19
185.0809631	0.52
186.1610565	0.30
190.0805817	0.10
191.208252	0.07
194.2546387	0.07
197.2225037	0.76
198.0760956	0.13
205.9371338	0.48
207.1644135	0.09
210.1121674	0.07
212.2037506	0.03
217.3751373	0.04
219.3785858	0.07
223.3943939	0.10
225.0737762	1.54
226.2540741	0.35
234.9564667	0.04
236.090744	1.06
237.1090088	0.19
238.0870514	2.04
239.0941772	0.58
239.9771118	0.10
251.0633392	0.11
253.0927734	100.00
254.1691437	3.67
255.0963593	0.76
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
196.9208832	0.70
206.7888489	1.13
212.8958282	4.73
254.8658752	3.10
266.8638916	0.93
284.8379517	3.42
287.1267700	1.47
290.7944336	100.00
297.0424194	0.18
306.8172302	0.52
314.9707642	6.09
338.9990845	0.32
357.0278015	4.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	299.09
Annotation	5-Hydroxy-7,2'-dimethoxyflavone
Peak:m/z	Relative Intensity
87.9505310	0.76
101.9472351	0.39
104.0880203	0.11
130.0639496	4.06
131.0377502	0.24
147.9404449	100.00
152.0032654	33.99
177.7538452	0.18
234.9664307	0.25
238.9530640	0.10
240.2282715	0.17
281.2117310	1.04
303.1323242	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	421.0023
Annotation	SC-58125
Peak:m/z	Relative Intensity
129.0050354	0.03
130.9310608	0.16
155.1784973	0.04
173.0129700	1.80
185.1422424	0.04
190.9667969	100.00
212.8452454	0.03
230.3074188	0.03
255.0824280	0.03
259.0212708	0.03
272.0930786	0.05
272.9625854	0.57
285.8880005	0.03
287.6365967	0.11
289.0071716	0.25
299.0806885	0.08
313.8538818	0.12
314.8923340	0.03
316.9223633	1.15
319.8693848	0.01
329.8492126	0.15
331.6633606	0.13
332.8728943	0.07
340.7934875	0.06
351.0519409	0.06
355.0453491	0.02
375.3299255	0.08
376.5491028	0.14
377.2751160	0.02
384.8403625	0.07
403.0097961	2.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	499.078
Annotation	Unknow
Peak:m/z	Relative Intensity
144.7322083	0.02
151.7960358	0.02
171.1412354	0.01
181.1028137	0.02
200.0473328	0.01
200.9581146	0.08
226.2904663	0.01
227.0849915	0.02
249.2742004	0.03
254.2481384	0.03
256.4224854	0.01
262.0205994	0.01
272.2211609	0.09
275.1322632	0.02
288.1917725	0.03
289.5147095	0.02
292.3425598	0.17
293.3986511	0.07
302.0573730	0.03
304.2051086	0.67
306.2101440	6.80
312.9194946	0.05
318.3303223	0.01
327.4649048	0.01
336.0682983	0.62
337.3517151	0.06
338.1879883	0.02
341.3322449	0.01
345.2627563	0.02
349.1705322	0.05
352.1831970	0.05
353.0972900	0.01
357.4671021	0.03
361.1348877	0.04
363.0746460	0.01
365.1047363	0.03
367.3994446	0.09
370.0152588	100.00
370.8480225	0.01
380.7040405	0.01
382.2004395	0.01
386.1300354	0.04
391.4887390	0.02
392.2752991	0.02
398.1761780	0.01
402.4596863	0.02
403.3537903	0.03
413.3623962	0.49
418.3157959	0.12
422.6250610	0.02
427.3495178	0.01
431.2979431	0.02
432.2970581	0.04
438.3446960	1.80
439.2796326	0.19
443.7434387	0.03
449.2174683	0.08
452.6275024	0.11
453.3816223	0.08
454.0227356	0.08
455.4290161	0.33
456.2698669	0.05
457.6567688	0.01
459.2834778	0.04
460.2786560	0.02
462.0999451	0.30
463.1341858	0.14
479.4839478	0.08
480.2642517	0.18
481.1944885	0.35
484.6216125	0.02
489.7360535	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	459.0659
Annotation	Unknow
Peak:m/z	Relative Intensity
161.9648743	0.37
176.8602448	0.09
179.1446228	0.47
202.5068359	0.12
208.9651947	0.04
225.1994629	0.11
230.8024902	0.08
237.9804840	0.24
243.0109406	0.05
254.5012207	0.13
257.3916931	0.07
267.3247986	0.14
273.1212463	0.10
274.2856445	0.10
275.4930420	0.23
285.1457214	0.18
302.1779785	0.05
308.0564575	0.30
309.2882080	0.05
312.1307068	0.28
314.3970337	0.21
316.7627869	0.15
323.0469055	0.09
325.0075073	0.13
330.1373291	100.00
334.6791382	0.11
339.0288086	0.17
345.8473816	0.04
346.8989563	0.32
350.3095703	0.04
359.7097778	0.05
360.9681396	0.04
364.5657959	0.16
365.5323486	0.06
368.3737183	0.08
369.0403442	0.12
369.9343872	0.06
371.0346985	0.21
381.1450500	0.24
384.0934143	2.87
401.1510925	0.14
413.4139404	0.26
416.0508728	0.05
423.0424194	1.65
427.8893738	0.10
429.3431091	0.12
441.1429138	15.87
442.3920288	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	368.1
Annotation	Zeanoside B
Peak:m/z	Relative Intensity
168.4461975	1.41
206.0474548	100.00
252.1322021	4.79
295.6268311	1.56
309.3771362	1.51
311.4258423	2.23
323.3566284	0.98
324.0713196	0.63
340.1214600	0.83
350.1000977	2.71
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	487.2547
Annotation	alpha-Ionol O-[arabinosyl-(1->6)-glucoside]
Peak:m/z	Relative Intensity
141.9556580	0.05
143.0221863	0.45
147.1349182	0.19
153.1666870	0.39
154.2587433	0.13
155.0477295	0.08
160.8103790	0.19
165.2204590	0.08
168.9762115	0.07
173.2455902	0.06
179.0999298	0.30
184.1906738	0.10
185.0488586	0.24
187.1146240	5.62
188.2126160	0.25
190.2601013	0.20
193.3624878	0.25
193.9991760	0.17
195.5407715	0.06
197.1281738	0.22
199.0538940	0.30
200.2724304	0.18
203.3334656	0.29
207.1699371	0.16
211.1813965	0.12
218.2933807	0.12
223.4216003	0.08
225.1412964	0.27
226.5219727	0.16
227.2440796	0.43
228.2279205	0.11
229.1320496	0.10
231.1839905	0.34
232.1097870	0.14
235.0086365	0.17
240.2017212	0.29
241.3179626	0.23
242.1988525	0.28
243.2448273	0.26
244.4014587	0.14
248.1757202	0.05
249.4364929	0.13
253.6260376	0.09
255.3065796	0.30
256.2921753	0.06
257.3757324	0.27
260.2061462	0.07
261.2931519	0.66
262.0947266	0.10
263.1051025	0.66
264.3119812	0.19
266.1837158	0.17
267.1334229	0.24
270.6733398	0.05
271.3672485	0.07
272.2196655	0.08
273.2379761	0.57
275.4672852	0.10
277.3837280	0.71
278.4262390	0.30
279.1926270	0.58
280.2837830	0.04
281.1458130	0.07
282.4113770	0.13
285.5776367	0.34
286.5020447	0.28
288.1617126	0.24
289.3153687	2.86
290.2339783	0.75
291.2365112	1.38
292.4709778	0.07
293.4053040	0.07
295.3682251	0.28
296.4223938	0.61
297.2517700	0.04
299.4614258	0.25
303.2631226	1.22
304.1374817	0.27
305.2741089	0.26
307.2770386	18.98
308.3565369	3.03
309.4602051	0.26
312.1616821	0.16
319.3986816	0.08
321.3423157	1.93
322.3208923	0.09
323.1682434	0.11
325.3012695	100.00
326.3851318	22.29
327.5903625	0.06
331.2067261	0.25
332.2283936	0.18
335.1399536	0.09
337.4205933	0.07
339.1669006	0.13
343.2512207	0.08
349.3036804	8.98
350.2414551	2.07
351.0883179	0.06
355.3981628	0.26
360.1362000	0.42
361.3636780	0.88
362.3412476	0.35
366.3167725	0.07
367.3155518	2.40
368.2347412	1.36
371.9788513	0.17
373.4306030	0.42
375.2938232	0.09
379.3053894	1.47
380.1115417	0.10
391.1361694	0.16
392.2660522	0.21
393.1264648	0.25
393.8039856	0.05
398.1935425	0.07
400.2225952	0.10
402.5439148	0.35
404.1440125	0.09
408.2837830	0.11
410.1173401	0.10
412.7368164	0.13
427.2100525	0.05
428.6805420	0.40
436.2981262	0.14
438.0619812	0.15
440.2864075	0.17
441.2105408	0.15
442.0504456	0.12
443.3444214	0.10
444.2984009	0.46
445.6359558	0.25
450.1051331	0.39
451.5022278	1.21
452.3714600	1.16
457.3873901	0.54
458.4126282	0.45
459.3011169	0.13
468.1135559	0.09
469.3353882	29.86
470.2859192	11.80
471.2355042	0.23
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
95.08240509	0.21
120.9711304	0.68
123.1923676	0.63
124.8726349	0.21
129.0031738	0.84
133.0504761	0.55
134.9707031	1.31
149.1617126	0.44
151.1015015	0.93
153.0060425	0.42
154.9638367	2.09
156.9938965	0.71
162.942627	0.46
167.0040283	0.59
168.980835	0.89
171.0560303	0.76
173.0336761	0.81
174.9000397	1.13
177.0276184	0.19
179.2213287	0.54
181.1445312	0.79
182.4423218	0.73
183.0431824	0.74
187.0880127	0.25
189.1682281	0.59
191.1651917	0.39
193.0491943	2.26
194.5529785	1.16
195.2077026	0.35
197.0908508	1.60
198.9762726	0.42
201.0935974	0.16
204.9919739	0.82
208.9855347	0.86
211.0419617	2.43
213.1311951	0.64
215.0068665	0.75
223.2531128	0.48
225.1074219	1.38
227.3112488	0.64
229.2361755	0.31
232.9243164	1.10
235.3628235	0.61
236.9996643	0.68
239.2055969	1.58
241.0994873	1.21
247.4226074	0.31
248.8995972	0.33
251.2658997	0.66
253.1049805	5.04
254.211853	0.44
256.5124207	0.78
257.1773682	1.36
265.3316956	1.79
267.1574707	1.97
269.2705078	2.55
270.0091858	0.16
275.1694336	12.20
276.1170044	0.46
279.1576538	0.18
282.3077698	0.35
283.2770386	0.81
290.9795837	0.38
293.2093506	100.00
294.3352966	1.84
302.1593018	2.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	422.025
Annotation	Glucoiberin
Peak:m/z	Relative Intensity
129.0118103	0.26
131.0641785	0.04
133.0833130	0.04
138.9537964	0.35
144.9948730	0.30
161.9131622	0.58
162.6918640	0.04
164.0781860	0.09
168.9774780	0.11
180.0031128	0.49
194.9792480	0.52
196.1115417	1.06
207.2401581	0.07
226.0051575	0.31
226.9446716	0.57
229.1156311	0.31
230.7416077	0.18
241.2089844	0.23
244.0749207	0.54
259.0833435	6.87
273.1678467	0.10
274.0357056	0.04
275.0479431	1.34
291.0740967	1.21
292.1468811	0.24
302.3143921	0.12
304.1791687	0.03
316.2119141	0.04
317.0192566	0.02
318.0891724	0.03
323.9770508	0.08
326.1876831	0.05
334.9650269	0.02
340.1769409	0.06
342.2355042	0.81
343.2748413	0.05
358.0426941	100.00
358.9043579	0.05
376.9892883	0.06
386.2640991	0.03
402.2900696	0.02
404.1600037	0.23
407.0543823	3.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	722.1863
Annotation	Unknow
Peak:m/z	Relative Intensity
191.9468689	0.32
226.1185608	0.17
235.0531921	0.19
247.2646332	0.63
255.2295380	0.31
262.1776123	3.55
279.2851562	2.32
279.9081421	7.42
297.2916260	0.24
298.3459473	0.32
307.9703064	1.37
316.4962463	1.67
317.8723755	2.35
325.1510010	0.83
326.2392578	0.84
343.4654541	1.63
344.0656738	0.20
346.2354736	0.84
358.3181152	0.24
361.2749023	1.73
362.1979370	5.56
363.0449219	2.16
376.2521362	0.42
378.6983032	1.40
393.3607788	0.66
394.9351196	0.30
397.2095337	0.64
397.8355103	0.26
425.6471558	0.34
427.9376221	0.53
437.0643311	1.32
442.5208130	0.61
455.0402832	0.19
458.4103394	0.33
459.1633911	4.09
460.7033691	100.00
461.5385742	1.18
463.0390015	0.45
479.0285645	1.89
480.1616211	2.37
483.6145020	0.34
490.9561157	0.38
497.2364502	0.58
521.0073242	0.45
524.6743164	1.21
530.0349731	1.16
538.1583252	1.23
540.6199951	67.84
541.5296021	0.87
556.9692993	0.56
570.0190430	0.66
571.2833862	1.09
572.9556885	0.96
588.4248657	0.41
590.6017456	0.64
591.7642822	0.57
599.5242310	0.59
604.6301880	0.65
624.6727905	3.97
625.5040283	3.20
633.3282471	0.18
641.2807617	0.84
641.9711304	1.57
646.9598999	0.30
658.3118286	1.95
686.6802979	1.21
703.4943848	0.57
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	413.1406
Annotation	N6-Carbamoyl-L-threonyladenosine
Peak:m/z	Relative Intensity
119.9751282	0.30
131.1534119	0.35
135.9436951	0.14
161.0839844	0.08
161.9665527	0.42
191.1949463	0.03
198.9741364	0.04
208.2223816	0.04
215.0324097	0.05
237.0766602	0.10
244.0406189	0.07
255.3641663	0.14
263.2118225	0.19
268.2319031	2.21
281.1013184	100.00
283.8627930	0.08
293.9739990	0.78
297.2509155	0.06
308.1896667	0.17
326.0690308	0.16
366.9801941	0.06
371.0274048	0.15
391.8816833	0.16
395.4274902	0.26
402.5189209	0.04
404.1850891	0.08
407.3121643	0.22
414.4242249	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	463.2546
Annotation	Unknow
Peak:m/z	Relative Intensity
139.3141327	0.04
142.9476776	0.16
144.9915466	0.11
152.2746277	0.08
155.0879669	0.04
161.1240387	0.39
162.9137573	0.06
179.0561066	0.44
181.1134644	0.15
183.4421692	0.08
195.1904449	0.32
196.9551392	0.06
203.0276489	0.09
207.0203857	0.09
209.5462952	0.10
212.2633972	0.03
217.0884399	0.25
235.3816071	0.04
236.8811798	0.11
247.3227844	0.04
249.3816833	0.08
251.2178345	0.22
253.0659180	0.08
255.2216187	2.28
256.2387695	0.07
257.1784058	0.15
260.9925842	0.38
267.2018127	0.06
268.2077637	0.09
269.2837830	0.45
271.2071533	0.17
283.2170105	4.08
285.3326416	0.95
293.0410461	0.09
297.2500610	5.52
298.1409302	0.05
299.4427490	0.22
301.2142334	100.00
302.2882080	0.49
305.9677429	0.08
307.2864380	0.17
312.0927124	0.06
315.4520874	0.21
317.0817871	0.11
318.9776306	0.09
325.3298645	0.42
327.2004089	0.26
328.1931763	0.25
339.0325317	0.04
343.2160950	5.02
345.0777283	0.05
348.9761353	0.18
349.9729614	0.08
354.0607910	0.16
355.2837219	0.57
357.4487305	0.09
361.0127869	0.16
363.6204529	0.18
366.4860229	0.10
367.2975464	0.29
369.2251892	0.07
373.3201294	0.32
374.1337585	0.30
375.4909363	0.04
377.0637207	0.11
379.1589050	0.13
383.6823120	0.25
384.3531799	0.25
389.1833801	0.10
397.5865479	0.07
399.2680969	0.10
401.4089050	0.07
402.9030151	0.13
403.9904480	0.30
405.3549500	0.04
406.9068298	0.11
408.9234314	0.06
414.5826721	0.22
417.0946655	0.57
417.7097473	0.11
419.0423584	0.65
419.9314575	0.54
421.4585266	0.37
425.0615845	0.05
427.3095398	0.46
428.2978821	0.20
443.3617859	0.23
444.3135071	0.17
445.2315979	1.46
446.1154175	0.06
448.0871277	0.29
461.9001160	0.10
465.7616272	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	595.07
Annotation	Unknow
Peak:m/z	Relative Intensity
192.8830719	0.61
212.8030853	0.13
219.0845032	0.40
257.0965881	0.33
275.0057068	0.19
281.1354370	0.30
290.8071899	0.29
292.8757019	0.11
315.8568115	0.16
335.0960693	0.18
352.9273682	0.25
358.7418213	0.25
369.1243896	0.22
380.7766724	0.14
386.9420166	0.06
397.0407715	0.54
402.8237305	0.08
411.1612549	0.20
415.0437012	100.00
416.1181030	3.13
419.1589355	0.39
420.0444946	1.09
424.9472656	0.14
426.5526733	1.91
428.7880859	0.79
433.3023071	0.79
434.3200073	0.11
439.6983032	0.65
440.3029785	1.45
442.6352539	4.90
449.1059570	0.56
456.9852905	0.20
458.6552734	1.26
459.3607788	0.50
461.2621460	0.18
466.8584595	0.12
475.1509399	0.12
486.2327271	0.05
488.7119751	21.72
508.9612427	0.98
510.7169800	23.87
526.8392944	2.47
530.2290649	0.51
530.9160767	0.90
534.7055054	0.78
546.4917603	0.15
548.6788940	31.50
552.6354370	0.60
570.6422119	0.43
572.1791382	0.20
577.1799927	7.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	215.03
Annotation	2-C-Methyl-D-erythritol 4-phosphate
Peak:m/z	Relative Intensity
70.8427887	0.22
74.9817810	0.04
81.1071167	0.06
86.9898758	0.29
88.9689789	1.35
100.9829254	0.45
106.7879944	0.28
113.0524292	0.67
118.9851532	2.27
124.9815979	0.31
127.0229645	0.02
131.0632477	0.86
143.0286865	2.04
143.7974396	0.03
148.9591522	0.54
154.9220428	0.04
161.0039673	4.41
178.9510345	100.00
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
122.5800095	0.15
190.9232025	0.44
196.8689270	2.62
206.9638672	1.63
213.2803345	0.24
238.9084473	0.72
250.9560547	0.41
268.8610229	1.83
270.6823730	0.17
271.8581543	0.38
273.2573242	0.14
274.7848206	100.00
279.1635132	0.14
286.9163208	0.25
290.8445129	15.76
298.8976135	2.08
312.9413147	0.19
323.9998779	0.17
340.3818970	0.72
341.0554810	0.57
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	976.99
Annotation	Unknow
Peak:m/z	Relative Intensity
275.9266968	0.05
311.2824402	0.05
313.2572632	0.08
313.8881531	0.06
425.0636597	0.51
426.1811523	0.08
443.4122314	0.08
474.1239624	0.11
476.2832642	0.16
494.4365845	0.06
495.2344971	0.31
518.2912598	0.09
527.2308960	0.06
556.1853027	0.04
560.4717407	0.07
581.2936401	0.14
584.4807739	0.09
603.3356323	0.09
615.4351196	0.16
642.3085938	0.04
660.5330811	0.09
681.3253784	0.07
688.1414795	0.10
693.8886719	0.22
707.4859619	0.04
720.0690308	0.04
735.4102783	0.28
784.2835693	0.10
814.4679565	0.06
816.4425049	0.05
847.4921265	0.04
866.6249390	0.15
878.8104858	0.11
882.4873657	0.16
902.5092163	0.09
912.0510864	0.08
919.3679810	0.83
924.5006104	0.38
925.7632446	0.06
929.1270752	1.14
931.5183716	0.12
932.5246582	0.12
934.7277222	0.78
935.4048462	0.72
937.4475708	0.43
938.4240723	0.82
939.7653809	1.88
940.6250610	0.22
942.4215698	4.16
943.3197632	0.54
944.9172363	6.18
946.3922729	0.12
948.1594849	2.26
949.1408691	0.30
951.3290405	1.20
952.0396118	0.06
953.5801392	4.07
954.2653809	1.46
955.2180176	0.28
956.3541870	15.93
957.9137573	2.74
958.6616821	1.47
960.0587769	2.38
960.8894653	0.69
962.0667114	2.61
964.3076782	1.44
964.9491577	1.39
965.8323364	1.67
966.6417847	0.34
967.6087036	0.45
975.6870728	0.10
978.5309448	0.71
995.8691406	0.02
999.6022339	0.44
1005.8793330	0.56
1016.6740720	0.91
1021.4500120	0.29
1022.5029300	0.07
1030.1928710	0.33
1032.3427730	0.52
1033.0758060	0.99
1034.5703120	0.70
1039.5260010	0.33
1040.4708250	0.77
1041.7593990	2.44
1042.7247310	0.14
1043.8594970	0.30
1045.5339360	0.97
1050.2182620	1.19
1051.0148930	1.03
1052.9006350	3.85
1054.7761230	0.64
1055.7365720	0.75
1057.1743160	1.14
1058.1973880	2.29
1059.6638180	1.31
1060.5554200	1.28
1061.2281490	1.97
1062.6400150	5.19
1063.3630370	0.52
1064.0977780	0.91
1065.9312740	7.58
1067.5137940	0.17
1068.7028810	2.64
1071.3193360	0.71
1072.4160160	0.63
1073.1119380	0.58
1074.5905760	3.39
1075.2076420	1.41
1076.3842770	0.60
1077.6561280	6.47
1078.7110600	0.98
1080.3731690	1.81
1081.2010500	2.61
1081.9353030	1.82
1083.1896970	0.07
1084.4427490	5.92
1085.2244870	1.95
1086.4896240	3.48
1087.5534670	7.24
1088.4619140	1.83
1089.9172360	1.72
1090.9057620	0.57
1091.9858400	0.44
1093.3212890	5.30
1094.2117920	2.03
1095.5802000	2.00
1096.4664310	3.33
1097.2329100	0.37
1098.4930420	5.38
1099.2475590	15.28
1100.8896480	4.16
1101.8869630	15.96
1103.4675290	7.88
1104.4533690	5.71
1105.5268550	3.28
1106.5318600	4.08
1107.4160160	0.77
1108.4707030	2.35
1109.4646000	6.17
1110.4936520	0.36
1112.4731450	30.99
1113.5435790	2.33
1114.8221440	9.40
1115.4377440	100.00
1116.7639160	3.52
1118.0397950	15.00
1118.7386470	4.39
1119.5634770	0.45
1120.7778320	2.19
1121.4124760	2.54
1122.5308840	1.87
1124.0284420	0.05
1125.2724610	2.98
1126.1020510	0.54
1128.0379640	1.61
1129.4729000	0.76
1131.1433110	0.62
1132.3764650	0.30
1133.8494870	7.00
1134.8645020	0.80
1136.6757810	14.48
1137.3010250	3.11
1138.1184080	0.18
1139.1691890	0.08
1140.2147220	0.49
1141.4882810	0.16
1143.8469240	0.35
1144.5523680	0.13
1154.3227540	1.14
1155.1132810	0.56
1156.8964840	0.11
1158.1787110	1.78
1160.0966800	0.13
1161.0354000	0.17
1167.5578610	0.52
1169.3546140	0.61
1172.4550780	0.16
1174.9896240	0.15
1175.7191160	0.08
1176.3229980	0.50
1176.9772950	0.12
1178.7883300	0.90
1180.9426270	0.13
1181.9271240	0.10
1182.7026370	0.06
1183.8110350	0.64
1185.1331790	0.49
1186.3576660	0.04
1187.8632810	0.35
1188.5980220	0.10
1190.9125980	1.29
1193.6135250	0.33
1195.0081790	0.58
1197.6406250	0.46
1203.0333250	1.03
1203.7915040	0.18
1208.0623780	0.37
1209.0634770	0.13
1210.6872560	0.13
1212.0740970	0.86
1213.0124510	1.24
1214.5007320	1.01
1215.3930660	1.87
1216.4627690	0.09
1219.5319820	0.21
1220.2291260	0.27
1222.7159420	0.12
1223.8367920	0.14
1228.1656490	0.90
1228.8994140	0.46
1229.6472170	0.65
1230.4865720	0.80
1231.0930180	0.28
1232.8146970	0.35
1234.0590820	0.82
1235.5876460	2.37
1236.3613280	1.38
1237.7247310	0.10
1239.6651610	2.19
1240.3354490	1.70
1241.0208740	0.46
1242.1418460	2.29
1242.9343260	0.33
1243.8039550	0.93
1245.6811520	1.42
1246.5412600	0.70
1247.6650390	1.22
1248.5402830	0.45
1249.5345460	3.97
1250.4594730	2.37
1252.8388670	2.16
1254.2174070	3.21
1255.1064450	0.62
1256.6627200	1.89
1258.0833740	0.97
1259.0727540	2.07
1259.9682620	2.97
1261.2541500	1.30
1262.7851560	3.20
1263.6137700	0.45
1264.6273190	1.03
1265.3024900	0.77
1266.5546880	0.10
1267.2636720	0.03
1268.4821780	2.37
1269.3383790	1.78
1270.3715820	0.10
1271.1717530	0.48
1272.3236080	1.31
1273.1582030	0.38
1274.7999270	1.60
1275.9543460	1.69
1276.8632810	0.28
1278.6367190	3.68
1279.6268310	2.33
1280.4803470	1.93
1282.2882080	1.18
1283.2318120	1.17
1284.3863530	0.11
1285.6121830	2.72
1287.1210940	0.56
1288.2209470	1.79
1288.9530030	1.28
1289.6369630	2.20
1291.1573490	1.54
1292.7227780	3.16
1293.4210210	0.46
1294.1386720	1.06
1295.2023930	1.12
1295.9737550	0.35
1297.3022460	1.86
1298.8077390	0.50
1300.9318850	2.04
1301.8593750	1.46
1303.5584720	1.12
1304.3372800	1.35
1305.1401370	1.26
1306.9537350	1.26
1307.9835210	1.19
1308.7305910	0.69
1310.1469730	0.20
1311.1873780	0.85
1312.3184810	3.12
1312.9453120	0.42
1314.5158690	0.43
1316.4385990	1.19
1318.4476320	0.63
1319.3988040	0.10
1320.3895260	0.13
1321.0407710	2.09
1322.4711910	0.06
1324.5167240	0.47
1327.1124270	0.52
1328.8582760	0.50
1329.7347410	0.36
1330.3507080	0.52
1331.0616460	0.47
1336.3519290	0.95
1339.9501950	0.24
1343.5599370	0.12
1344.4346920	0.51
1345.2186280	0.40
1349.8615720	0.30
1351.7213130	0.91
1353.3165280	0.71
1357.1057130	1.42
1358.6486820	0.05
1360.6314700	0.27
1362.0920410	0.81
1366.3801270	1.41
1370.2982180	0.27
1371.3400880	0.12
1379.9433590	0.50
1381.3372800	0.26
1384.9528810	0.37
1390.4149170	0.49
1402.9432370	0.66
1403.5726320	0.59
1406.6605220	0.11
1411.1079100	0.51
1436.1354980	0.75
1439.4351810	0.45
1447.6282960	0.50
1448.4205320	1.48
1452.8544920	0.37
1457.5670170	0.24
1459.8145750	0.25
1462.6885990	0.09
1466.2399900	0.29
1471.3103030	0.38
1474.3605960	0.52
1476.7176510	0.92
1477.5715330	0.70
1478.4478760	0.60
1479.7410890	0.82
1484.0316160	0.21
1489.4359130	1.27
1493.0712890	0.55
1494.9520260	0.02
1500.7280270	0.12
1505.5428470	0.41
1506.5487060	0.48
1510.9779050	0.37
1512.2318120	0.36
1514.3808590	0.27
1517.7141110	1.10
1522.6832280	0.39
1526.2677000	0.20
1537.4503170	0.25
1541.1578370	0.53
1545.5496830	0.50
1548.6394040	0.12
1553.9237060	0.32
1560.9840090	0.46
1565.9776610	0.27
1567.7349850	0.23
1583.4439700	0.11
1585.4404300	0.22
1586.8334960	0.47
1597.6820070	0.47
1604.0787350	0.14
1605.8150630	0.19
1609.3753660	0.42
1611.3741460	0.38
1624.0064700	0.35
1630.7321780	0.09
1648.8480220	0.09
1650.9053960	0.19
1664.9356690	0.04
1688.2658690	0.09
1703.7122800	0.12
1705.4265140	0.12
1720.8028560	0.08
1723.9417720	0.05
1730.9035640	0.21
1742.5318600	0.05
1767.1607670	0.26
1780.2515870	0.26
1826.5069580	0.06
1845.6848140	0.05
1848.6502690	0.08
1862.2877200	0.21
1876.7025150	1.05
1884.1610110	0.08
1893.2218020	0.13
1911.0225830	0.08
1914.4245610	0.06
1917.9084470	1.26
1922.2388920	0.54
1929.3267820	0.17
1932.3341060	0.09
1937.5648190	0.04
1943.0241700	1.54
1949.8132320	0.35
1950.5627440	0.14
1956.0075680	0.38
1960.7771000	0.16
1973.5305180	2.21
1975.3472900	0.04
1985.0520020	0.03
1989.7790530	0.14
1991.4484860	0.04
1994.8869630	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	325.1383
Annotation	Unknow
Peak:m/z	Relative Intensity
127.2443695	0.02
146.0708313	31.85
152.8411560	0.09
162.9911194	0.06
173.0681763	0.04
177.7211761	0.05
183.4923401	0.03
188.7909851	0.02
192.8840790	0.01
194.2454071	0.03
196.5302124	0.05
197.9829559	0.02
202.7121582	0.08
212.1149292	0.08
214.7581482	0.02
226.2622681	0.04
238.0070190	0.03
246.5075989	0.02
251.9710999	0.02
261.1523132	0.05
264.1726685	0.11
268.1593018	1.25
269.2602844	3.69
276.4229736	0.03
277.3154907	0.06
279.3215942	0.14
285.9287109	0.03
288.3969116	0.02
293.8413391	0.04
297.0994568	0.02
301.4304504	0.02
302.2734680	0.03
303.1345825	0.17
303.8930054	0.19
305.4942017	1.35
307.0920715	21.08
307.8867188	100.00
308.5493164	0.31
337.7641907	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	959.2817
Annotation	1,2,2'-Trisinapoylgentiobioside
Peak:m/z	Relative Intensity
272.2846985	0.05
274.2611389	0.10
275.1452332	0.02
277.0340271	0.13
277.9386902	0.06
279.8305054	0.10
287.2953186	0.13
289.0189209	3.76
290.1271362	0.17
295.1955872	0.24
296.3810730	0.09
298.3439941	0.05
305.3008423	0.03
307.1965332	0.07
313.1816711	0.15
316.2841187	0.06
319.3889771	0.03
325.1862793	0.31
326.3157043	0.08
331.0311279	0.40
336.3038330	0.06
348.6895752	0.04
349.3203735	0.02
367.2940063	1.37
368.2961426	0.16
369.3835449	0.03
373.2985840	0.06
377.4885559	0.03
385.2638245	1.03
386.1577148	0.07
396.1957397	0.06
399.4945679	0.05
409.4626465	0.03
413.0905762	0.12
415.3864746	0.08
425.2908936	0.02
427.1425781	2.94
428.2843628	0.34
430.2377319	0.04
439.3316650	0.11
449.2000732	0.13
453.2385864	0.07
457.2235718	2.20
458.1602173	0.18
465.0845947	0.02
466.7589722	0.02
469.2421265	2.74
470.2493896	0.20
471.1035156	0.06
480.3142700	0.04
483.0590820	0.07
485.3028564	0.03
487.2467651	2.75
488.3876953	0.30
491.3613892	0.06
493.4537354	0.21
495.5565796	0.18
497.5025024	0.35
509.3828735	0.02
511.1990356	10.06
512.1401978	1.27
515.4033813	0.45
516.2542725	0.03
529.2348022	8.68
530.2171631	1.48
531.0125732	0.07
547.0682983	0.04
555.4299316	0.03
591.4450073	0.10
631.1652222	0.05
633.5078735	0.29
639.1254272	0.03
645.2373047	0.03
648.4635620	0.12
651.4747314	0.11
653.7284546	0.05
655.3640747	0.02
656.6095581	0.02
661.4902344	0.10
663.1611938	0.39
664.4207764	0.07
668.5150757	0.19
675.1358032	0.33
689.4705200	0.05
690.4580078	0.11
693.0691528	1.10
694.1799927	0.42
700.3815918	0.19
703.4864502	0.04
716.7546997	0.10
717.4339600	1.00
718.4829102	0.11
720.0651245	0.04
721.4148560	0.22
722.4026489	0.04
724.0834351	0.04
735.2257690	100.00
736.2819214	17.11
744.4403687	0.04
748.8784790	0.07
749.9463501	0.24
751.1865845	0.05
753.1066895	2.42
753.9519653	0.53
762.9397583	0.04
774.3816528	0.02
776.4177856	0.08
785.4638062	0.04
786.5776367	0.02
821.4509888	0.12
822.6584473	0.04
828.7297974	0.03
837.3425903	0.16
838.5338745	0.05
845.3186646	0.08
859.6174927	0.03
881.9140625	0.05
893.2789917	0.09
897.2590942	0.03
898.1624146	0.04
898.9763794	0.04
900.7313843	0.09
911.4607544	0.09
916.1152344	0.29
923.3425903	0.03
930.7238770	0.08
941.1845703	0.98
942.3662720	0.36
942.9790039	0.07
945.9743042	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	386.9394
Annotation	Unknow
Peak:m/z	Relative Intensity
114.8702240	0.06
115.8507690	0.01
159.0109100	0.64
159.9837189	0.11
199.1657410	0.03
200.2387695	0.02
217.9363403	0.01
228.9934387	0.07
229.9528503	0.09
257.1669006	0.01
257.8170776	0.01
271.0938721	0.01
272.9832764	100.00
273.9809875	42.37
274.9724426	0.02
312.2652588	0.04
325.9878235	0.03
332.8138733	0.02
341.3996277	0.02
342.0220642	0.02
343.9968872	0.02
356.7125549	0.01
375.0225525	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	306.0763
Annotation	Glutathione
Peak:m/z	Relative Intensity
110.9772415	0.19
122.8301697	0.22
127.9878311	11.42
134.8782959	0.32
140.7394867	0.40
143.0128479	6.23
145.2038879	0.88
146.1914673	0.24
160.0383606	14.28
166.1544037	0.62
167.1420593	0.96
169.8865967	0.33
171.2119751	0.70
177.0545349	8.63
179.1224670	11.63
182.9855042	0.29
185.0289612	0.35
197.0788879	0.26
198.0412903	0.38
210.1567383	5.80
213.1247253	0.73
231.0578613	0.19
235.9205017	0.36
242.0790405	0.61
243.4381714	0.70
244.0988159	0.77
246.2608643	0.28
254.1515808	97.48
272.1506958	100.00
288.0546875	76.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	307.0825
Annotation	Oxidized glutathione
Peak:m/z	Relative Intensity
109.1622925	0.11
130.0447083	50.20
131.1141357	0.20
145.9801178	0.12
162.1790466	0.74
163.0678406	0.18
177.1525574	0.37
178.9559326	2.95
179.8801880	0.17
191.0222473	0.22
191.7781677	0.23
199.2560730	0.25
209.7116394	0.08
211.1545715	1.19
213.1364136	0.10
224.2479248	0.19
231.0384827	1.54
233.0044861	0.10
234.0792847	0.25
234.8516541	0.25
238.1346130	0.40
242.5694580	26.93
243.2466431	5.59
244.1875610	0.27
245.1218262	0.72
246.7120972	1.50
257.0846558	0.52
260.4486389	1.65
261.8558960	0.15
267.1590576	0.87
269.6296692	35.01
271.1936646	0.07
273.2124329	0.35
273.9641113	0.09
275.6355896	45.32
276.8195496	0.24
278.3598328	0.48
280.1278992	0.26
287.0782776	0.20
287.6876221	0.15
289.3079224	2.42
290.5264587	1.20
291.3435059	0.15
298.6168213	92.86
299.6203003	0.23
308.3038330	0.18
322.2038574	0.22
323.0989990	0.25
340.0832825	0.38
355.1471863	100.00
356.1966248	7.13
364.0233459	0.81
365.0608215	0.48
381.1477356	8.70
382.1673279	0.65
391.1379395	0.44
392.6377563	0.08
409.1448059	14.71
410.1467896	1.70
420.6710510	0.21
457.1672058	0.49
458.3846741	0.18
466.2046814	4.77
467.0509644	0.96
468.1346741	0.43
475.3783569	0.32
476.1786499	0.17
484.1741028	88.39
485.2101135	6.46
493.9828186	0.08
519.9880981	0.95
520.9207153	0.63
538.1975098	21.52
539.3049927	1.19
550.2793579	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	983.9789
Annotation	Unknow
Peak:m/z	Relative Intensity
316.0176392	0.13
331.4365234	0.07
336.2457886	0.36
358.4160156	0.09
359.2689209	0.05
374.5654297	0.17
376.1492310	1.40
377.4252319	0.28
382.2792969	0.06
409.1141357	0.05
410.2590942	0.37
411.2885132	0.25
428.4624023	0.05
432.2954102	0.05
433.3318481	0.09
434.4533386	0.13
451.2231140	1.18
452.0097351	0.22
453.2341919	0.13
477.4249878	0.66
489.0197144	0.07
495.1030273	0.56
496.3374023	0.05
504.1898804	0.06
505.3532715	0.45
506.3365479	0.30
523.3087158	2.09
524.2180176	0.15
534.2019043	0.14
543.3358765	0.07
552.0618896	0.18
570.8198242	0.26
580.3256836	0.48
589.3051758	0.12
598.4152222	4.27
599.3602295	1.61
600.0854492	0.27
611.9123535	0.19
620.8474121	0.05
636.1855469	0.18
642.7351074	0.07
654.6080322	0.22
658.9215088	0.36
675.7251587	0.06
693.3731689	0.30
694.3271484	0.10
699.4760742	0.07
711.3957520	0.14
712.3923950	0.15
719.5196533	0.08
720.2603760	0.11
737.6323242	0.03
739.2755737	0.07
750.8032837	0.15
751.5177002	0.06
754.7114258	0.22
760.4421997	0.21
768.3236084	2.49
768.9483643	1.92
769.6209106	0.35
771.4855957	0.14
774.0155029	0.20
774.6494141	0.22
776.2233887	0.16
778.7736816	0.15
780.7797852	0.17
782.7752686	0.03
792.5231934	0.16
797.4521484	0.31
798.9243164	0.07
803.8184814	0.30
805.7130127	0.05
806.5236816	0.05
808.1782227	0.16
809.1204834	0.10
811.5672607	0.39
819.5225830	0.12
823.5032959	0.25
828.1181641	0.06
833.0303955	0.11
835.1947021	7.34
835.7985840	0.52
837.3552246	0.17
843.7812500	0.30
846.4489746	0.05
849.9849854	0.92
851.2666016	0.23
856.1147461	0.15
856.9857178	0.46
860.3289795	0.13
863.4039307	0.29
865.0780029	0.49
867.3592529	0.81
868.6923828	0.28
871.9360352	2.90
872.6534424	0.15
874.4992676	0.16
875.7644043	0.14
876.9278564	0.06
883.1890869	0.29
893.1463623	0.17
895.3852539	0.10
896.3880615	0.74
897.2868652	0.13
899.1545410	2.64
900.7540283	28.61
901.9243164	0.54
902.7406006	0.22
903.4071045	0.23
906.6054688	0.04
907.4042969	0.40
910.8845215	0.19
912.1433105	0.11
913.1628418	0.09
920.6801758	0.22
922.0139160	0.47
922.7287598	0.27
924.4366455	0.23
925.0672607	0.35
926.1447754	1.35
927.0329590	0.40
928.6348877	1.81
930.4848633	14.58
931.3320312	1.34
931.9985352	2.69
932.8170166	5.29
933.5571289	0.51
937.4830322	58.64
938.3824463	2.95
939.5117188	0.91
940.4483643	0.61
941.6762695	0.49
942.5755615	0.20
943.6596680	0.20
944.4490967	0.22
946.7946777	0.27
948.1763916	0.12
948.9980469	0.14
950.3994141	0.57
951.1651611	0.17
951.7926025	0.75
952.6235352	0.05
954.3908691	0.92
955.1453857	0.33
955.8309326	0.07
956.8826904	0.95
958.6169434	4.43
959.5756836	0.41
960.3881836	1.29
961.2412109	7.33
962.3024902	0.33
963.2303467	0.18
965.7369385	100.00
966.9377441	3.40
967.8393555	0.92
968.8190918	0.32
969.7476807	0.68
970.7275391	1.22
971.7364502	0.41
972.3469238	0.02
974.7591553	0.27
975.5629883	0.18
980.0301514	0.12
991.5283203	0.12
992.3869629	0.18
993.7363281	0.16
1000.0781250	0.37
1003.9399410	0.96
1005.1081540	0.29
1012.9074710	0.37
1013.6376950	0.12
1015.3095700	0.08
1022.9171140	0.18
1023.7507320	0.14
1029.2921140	0.94
1030.3100590	0.22
1031.1867680	0.27
1032.1586910	0.40
1033.2404790	0.22
1039.6284180	0.74
1040.8829350	0.34
1041.6652830	0.15
1049.5881350	0.10
1050.7911380	0.45
1056.4732670	13.56
1057.5358890	0.13
1060.1914060	0.04
1065.3291020	0.59
1065.9375000	0.05
1066.6223140	0.17
1075.3900150	5.29
1076.2442630	0.46
1079.6442870	0.12
1082.1993410	0.17
1096.2302250	0.16
1100.7718510	0.32
1103.6870120	1.03
1104.8005370	0.58
1105.9482420	0.07
1106.8383790	1.09
1107.4547120	0.41
1109.7214360	0.07
1113.1887210	90.75
1114.3676760	0.78
1115.1677250	0.29
1116.2608640	0.19
1117.5878910	0.10
1119.4725340	0.24
1120.6348880	0.15
1122.4606930	0.05
1123.8596190	0.20
1133.0544430	0.19
1135.2084960	0.06
1140.6242680	0.96
1141.5791020	0.07
1142.4566650	0.45
1143.9074710	0.72
1146.3593750	0.17
1150.9938960	0.49
1153.1665040	0.23
1153.8503420	0.15
1156.5883790	0.46
1160.4953610	0.34
1162.2058110	72.88
1163.2364500	2.61
1164.0974120	0.57
1165.0385740	0.18
1165.8004150	0.12
1166.4914550	0.15
1168.5568850	0.16
1171.6287840	0.19
1173.0585940	0.15
1174.3020020	0.09
1175.5039060	0.12
1176.5935060	0.20
1179.6368410	0.04
1181.4250490	0.11
1182.4382320	0.20
1184.7250980	0.16
1188.4406740	0.19
1191.1958010	0.07
1191.9715580	0.08
1193.9117430	0.23
1194.9821780	0.30
1198.7192380	0.07
1200.5534670	94.67
1201.5261230	3.03
1202.5281980	0.72
1203.3833010	0.22
1204.4990230	0.09
1209.6175540	0.20
1212.0683590	0.28
1215.3981930	0.11
1223.6667480	0.08
1226.8007810	0.20
1230.7772220	0.04
1231.5532230	0.58
1234.6181640	0.02
1238.2800290	0.49
1239.9067380	0.11
1240.7611080	0.17
1241.5307620	0.13
1243.5445560	0.77
1247.9375000	0.19
1249.0466310	6.33
1249.6804200	78.64
1250.9094240	0.66
1252.2062990	0.42
1253.8967290	0.10
1254.5361330	0.13
1256.0271000	0.16
1258.8295900	0.15
1259.5469970	0.12
1260.6965330	0.18
1261.6698000	0.08
1263.3251950	0.25
1268.3046880	0.22
1271.0817870	0.20
1272.5838620	0.72
1274.5021970	0.10
1279.6135250	0.11
1281.7379150	0.08
1283.7183840	0.52
1284.4515380	0.06
1289.4302980	0.04
1290.3786620	0.05
1291.9038090	0.13
1293.8682860	0.23
1294.6241460	0.06
1295.6495360	0.20
1296.5242920	0.16
1300.6229250	0.06
1302.8843990	0.08
1306.4180910	0.03
1308.9012450	0.29
1314.6202390	0.12
1325.1755370	0.10
1332.7860110	0.57
1338.4086910	0.04
1342.6082760	0.17
1347.5474850	0.09
1348.8690190	0.73
1349.4696040	0.28
1351.0994870	0.11
1358.7857670	0.05
1362.8648680	0.11
1363.7329100	0.06
1364.7854000	0.09
1370.7723390	0.22
1375.7607420	0.08
1397.6508790	0.10
1398.7398680	0.03
1407.5961910	0.04
1409.1237790	0.11
1413.0556640	0.09
1419.1654050	0.14
1420.1434330	0.09
1421.4459230	0.23
1426.1356200	0.13
1436.7401120	0.10
1437.9598390	0.08
1440.7381590	0.17
1458.1757810	0.09
1458.7971190	0.08
1462.7882080	0.07
1467.6409910	0.32
1476.1307370	0.06
1487.8875730	0.20
1489.3586430	0.07
1506.3223880	0.21
1519.5361330	0.13
1522.2296140	0.08
1526.0008540	0.23
1535.6151120	0.17
1536.6356200	0.21
1539.8841550	0.10
1541.9337160	0.06
1555.7460940	0.08
1556.9295650	0.05
1558.5858150	0.04
1569.0480960	0.05
1575.8568120	0.09
1595.8020020	0.07
1599.7271730	0.04
1606.9837650	0.03
1646.1911620	0.13
1649.9180910	0.09
1659.9396970	0.04
1668.2276610	0.21
1673.1832280	0.05
1674.2935790	0.28
1719.4027100	0.07
1731.1229250	0.07
1734.5318600	0.85
1741.0169680	0.23
1748.1080320	0.10
1762.0845950	0.12
1768.3621830	0.03
1773.9102780	0.18
1782.7855220	0.06
1786.3288570	0.19
1791.1403810	0.36
1798.9024660	0.03
1802.0819090	0.11
1813.3995360	0.05
1817.1575930	8.33
1824.1658940	0.19
1828.9027100	0.05
1839.7906490	0.05
1842.9241940	0.11
1852.8009030	0.03
1856.3963620	0.11
1861.2868650	0.78
1867.7640380	0.06
1869.4168700	0.71
1880.0349120	0.03
1899.5568850	0.09
1902.8111570	0.04
1903.6727290	0.04
1905.0794680	0.32
1909.9670410	0.06
1933.3409420	0.03
1937.7614750	2.03
1940.5280760	1.56
1941.6467290	0.11
1948.3182370	0.27
1949.1239010	0.11
1949.8853760	0.47
1953.9761960	0.20
1955.5164790	0.08
1961.8116460	1.02
1964.4503170	0.06
1966.5670170	0.09
1974.2731930	0.05
1975.3958740	0.12
1977.4195560	0.03
1978.8043210	0.07
1989.2996830	0.04
1994.0882570	0.14
1995.7601320	0.38
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	357.25
Annotation	13,14-dihydro-15-keto Prostaglandin E1-d4
Peak:m/z	Relative Intensity
128.7453156	0.66
142.935257	0.31
160.9338684	0.25
171.0143738	1.44
173.0703278	1.14
175.2973633	0.35
183.3543701	0.42
184.9847565	3.31
186.7453308	3.80
189.1035156	0.92
195.2036438	0.25
198.9582214	1.73
200.153595	0.52
200.9958191	3.15
203.2344513	0.31
211.1439972	3.02
213.6769104	0.40
215.0903931	2.57
217.1503906	0.65
225.2868958	0.41
227.2418518	0.92
228.0594482	0.47
229.23172	5.32
231.2610168	1.50
235.3659363	0.27
239.2823181	0.48
241.3890686	0.65
242.263916	0.68
243.1786194	1.63
245.3807678	0.39
254.6950378	0.23
255.4065247	1.90
256.0568848	0.39
257.2122192	1.87
259.355072	1.18
260.9249878	0.40
263.2894592	2.57
267.0632019	0.23
269.3045349	3.08
271.315918	5.89
273.2119751	4.48
275.3332825	0.64
277.7620239	0.42
279.0771484	0.59
283.2289124	3.32
285.218811	5.82
287.3917847	1.03
292.3032837	0.29
295.3294067	0.35
297.3215942	2.47
299.2957458	5.08
301.2727356	2.84
303.1947632	0.25
310.3358459	1.19
311.1011963	1.53
313.2588501	4.20
314.2116089	0.22
315.4095764	3.45
321.4405518	2.17
323.2609863	5.78
327.1115723	0.46
337.3226318	2.04
339.2493286	100.00
341.2724304	23.23
342.8969116	0.18
349.1333618	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	518.2523
Annotation	PS(18:3(6Z,9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
153.0073242	10.24
168.9185028	0.07
170.9737854	0.32
182.4278107	0.13
201.0308838	0.08
226.1341248	0.19
233.9488373	0.04
240.0025177	0.58
244.0199585	0.40
245.2630615	0.05
267.3444214	0.07
273.5404663	0.05
275.1569214	0.09
280.1915283	0.17
285.2744141	0.14
292.8480530	0.06
311.3024902	0.11
321.0255127	0.18
329.0004883	0.10
345.5504761	0.20
361.6061401	0.05
364.4751587	0.07
370.3846436	0.08
379.0128174	0.06
390.3148193	0.06
397.1897583	0.10
401.6091919	0.09
413.3029785	0.18
415.4503784	0.04
417.2241211	0.14
431.3685303	100.00
433.2673950	0.05
444.1595459	0.20
445.3106079	0.05
446.2222900	0.11
450.0851440	0.24
457.5113525	0.05
461.5954590	0.07
464.3387451	0.16
471.1054077	0.12
472.1530151	0.23
473.3523560	0.36
474.1715698	0.07
475.6408081	0.70
479.9989014	0.45
482.0480347	2.06
482.9031372	0.05
488.0316162	0.22
489.8468018	0.09
499.7302856	0.79
500.8027954	0.71
501.6069946	0.04
503.3235474	0.40
508.3648071	0.05
516.1633301	0.08
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
114.9231567	5.65
115.9717255	2.35
117.0282288	3.05
130.9810181	0.52
132.3884430	0.09
133.1596375	0.07
158.9779053	100.00
159.9499817	48.85
160.9014893	57.33
175.1587524	0.02
187.0360107	0.02
198.9795837	0.10
199.9857483	1.88
201.0065918	2.62
203.2018127	0.03
217.9514465	0.65
219.0421448	1.20
229.8936768	22.84
230.8971252	31.43
246.2131348	0.35
246.9241028	0.30
275.0989990	0.18
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
107.1407318	0.08
109.1055527	0.03
111.1456451	0.06
118.3563461	0.01
127.0760498	0.06
128.0653687	0.01
131.8091888	0.01
133.0966492	0.02
135.0187988	7.26
136.0594177	1.00
155.0006256	0.19
156.0938110	0.02
161.0179138	0.72
162.0397949	0.23
171.0905762	0.01
172.9816742	2.51
174.1544647	0.29
175.1616516	0.02
175.8259583	0.05
179.0166626	43.05
180.1284180	6.64
191.0046997	100.00
192.0884094	13.83
216.0453491	0.09
219.1503296	0.01
231.0829468	0.02
234.3025818	0.04
267.2181091	0.03
281.1821594	0.01
307.1737061	0.02
308.1130371	0.03
309.2984009	0.07
310.1644897	0.18
335.2521362	0.04
336.1987915	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	303.02
Annotation	Unknow
Peak:m/z	Relative Intensity
87.9560242	1.19
94.8742294	0.14
113.1730652	0.36
113.9529572	1.11
114.9266281	3.15
128.0910950	0.07
130.9499207	4.47
131.8920135	100.00
132.9912415	2.51
153.9649506	0.09
169.8264923	0.09
172.9014130	0.11
187.9246521	0.07
195.0442810	1.44
219.0222168	1.11
221.0574951	0.04
239.1046448	0.22
242.0809326	0.08
245.0797119	0.07
260.1696777	0.09
265.7755127	0.04
284.2152710	1.12
285.0192261	0.76
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	338.0878
Annotation	6-hydroxyindole-3-carboxylic acd 6-O-beta-D-glucopyranoside
Peak:m/z	Relative Intensity
104.0373688	0.10
105.1462097	0.02
106.2231598	0.02
112.9857330	0.03
131.1109772	1.05
132.0494232	7.88
133.1069183	1.82
156.1333923	0.04
159.0597229	0.02
163.0632629	0.04
173.2267303	0.02
176.0237274	100.00
177.0562744	29.90
177.7382202	0.03
181.1536865	0.14
185.9783936	0.01
191.1393738	0.05
199.0705109	0.05
204.9924316	1.92
205.5956116	0.03
213.4060364	0.04
218.1551208	0.20
219.1389160	1.90
241.0642090	0.64
248.0769958	0.05
249.2656860	0.05
250.4265137	0.10
253.1777649	0.06
260.1968689	0.04
278.1947021	0.27
279.4220276	0.08
281.3355103	0.03
291.3870850	0.06
292.8332214	0.19
294.9418335	0.08
305.0439453	0.03
311.2005920	0.08
316.9272766	0.11
320.1389465	0.02
321.2347412	0.72
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1024.52
Annotation	Unknow
Peak:m/z	Relative Intensity
303.5716248	0.14
314.4276733	0.16
330.4797058	0.08
336.1687317	0.35
339.4371948	0.06
343.2530823	0.10
343.9383545	0.05
359.5118408	0.07
389.0659790	0.19
390.1820068	0.27
396.4097290	0.05
399.3946533	0.58
406.0932007	0.21
424.2878723	0.20
430.2188721	0.10
436.0730591	0.24
437.0459900	0.51
438.3549805	0.09
440.3003540	0.14
458.2644653	0.06
470.8991394	0.09
471.5090332	0.26
472.2908936	0.08
478.1268616	0.10
481.3432922	0.12
485.4368591	0.09
487.6706543	0.05
497.3857727	0.26
499.4119873	0.19
511.0677490	0.05
525.4781494	0.24
539.4320068	0.33
541.3302002	0.12
542.8171387	0.16
553.4183350	0.38
554.1705322	0.18
555.3001099	1.05
567.1196289	0.25
569.2606201	0.27
569.9361572	0.26
579.4346924	0.10
581.2559814	0.23
584.5757446	0.11
599.0081177	0.61
600.4903564	0.39
605.3487549	0.27
612.8088379	0.43
614.0656738	0.12
621.6072998	0.16
626.9217529	0.49
637.6199951	0.17
641.6165161	0.07
645.3469849	0.07
650.6176147	0.30
652.6270142	0.21
655.9683838	0.04
658.4838867	0.06
661.5675659	0.08
662.9279785	0.08
667.5654297	0.10
670.3500366	0.38
674.6102295	0.23
678.0433960	0.06
679.8455811	0.47
681.0698853	0.13
683.5349731	0.73
684.4099121	1.04
685.2857666	0.40
686.7668457	0.36
688.5391846	0.14
690.3530884	0.28
697.9596558	0.14
710.2810669	0.06
711.1717529	0.08
714.1961060	0.11
717.4223022	0.20
727.0846558	0.27
728.3264771	0.20
737.4780273	0.20
738.3672485	0.52
740.5555420	0.25
742.5442505	0.21
748.5197754	0.84
753.1610107	1.27
754.5758057	0.78
755.3347168	1.03
756.5127563	0.65
757.5039673	0.46
758.7244873	0.13
762.5338135	0.08
763.6845703	0.08
764.6872559	0.26
765.6847534	0.11
770.3216553	0.05
772.3682861	0.16
774.5787964	0.20
778.6705322	0.33
779.6412354	0.75
781.3618164	0.17
783.6569824	0.23
784.8874512	0.46
789.4799805	0.42
791.0598145	0.21
796.9042969	0.27
801.7843018	0.31
802.7016602	0.37
808.4777832	0.68
812.4686279	0.28
817.4554443	0.84
818.2648926	0.26
819.6656494	0.72
820.4044189	0.04
821.7917480	1.23
822.5264893	1.10
823.4517822	2.30
824.0579834	0.06
826.7070312	0.06
827.7028809	0.25
828.6688232	0.06
831.6776123	1.18
834.9820557	0.57
835.8039551	0.30
836.5313721	0.36
837.4621582	0.15
838.5405273	0.50
839.4399414	0.56
840.4228516	0.36
841.6425781	0.62
844.5417480	0.06
846.1839600	0.25
847.7707520	0.69
851.5985107	0.63
854.5301514	1.18
855.9516602	1.05
856.6835938	0.47
857.6330566	1.42
858.2852783	1.97
860.2138672	0.80
861.1170654	0.10
863.9479980	0.52
864.7961426	0.06
868.2962646	0.96
870.6756592	0.05
871.8443604	0.89
874.1046143	0.27
875.0190430	0.61
877.1740723	0.28
879.0982666	0.11
883.0609131	1.06
885.7332764	0.27
886.6779785	0.58
888.1346436	1.12
889.0882568	0.70
890.8131104	1.91
891.6889648	1.15
893.5377197	2.77
894.2810059	4.83
895.1662598	0.17
895.9050293	0.23
897.7186279	3.60
898.7824707	0.54
901.4218750	0.10
905.2255859	0.12
907.7524414	0.78
908.5837402	0.16
911.7119141	0.30
912.6007080	0.51
913.5944824	0.10
917.5355225	0.34
918.6696777	0.23
920.9436035	1.02
921.6489258	0.18
924.2838135	0.15
926.4625244	1.07
927.3360596	2.34
931.1352539	2.12
931.9454346	0.62
932.5889893	1.85
933.9903564	3.21
934.7500000	0.43
936.3862305	0.10
937.2750244	0.28
939.5931396	7.44
940.5716553	2.05
941.5273438	0.80
942.2805176	0.41
943.6014404	0.62
944.9182129	0.54
946.0825195	1.67
947.8734131	0.23
949.1407471	2.69
949.8371582	2.00
950.6505127	0.37
951.3878174	0.18
954.3985596	0.62
955.2336426	0.29
956.8073730	0.54
958.3843994	1.50
959.7823486	0.21
960.9920654	1.14
961.8149414	0.29
962.5351562	0.18
964.5379639	0.08
966.2156982	0.06
967.0214844	3.42
967.7109375	1.57
969.2318115	0.23
970.1204834	0.53
970.7601318	0.68
971.4017334	0.18
972.2120361	0.07
974.6857910	6.13
975.4462891	2.63
976.2468262	0.41
977.4030762	0.04
982.2142334	0.22
983.5076904	0.81
986.5937500	0.71
988.5118408	1.26
989.4890137	0.47
992.5142822	1.04
995.2250977	0.14
996.7658691	1.08
997.9560547	2.77
998.7565918	1.07
1000.7658690	0.50
1001.4396970	0.23
1002.3906250	1.09
1003.0024410	3.59
1003.6291500	0.45
1004.4064940	1.47
1005.9010010	3.14
1007.0579830	2.83
1008.4182130	5.77
1009.5401610	1.38
1010.4493410	0.90
1012.0716550	0.24
1014.1639400	0.39
1031.8266600	0.06
1034.6110840	0.48
1035.2431640	1.15
1037.2115480	0.15
1038.2253420	0.26
1042.7578120	1.98
1043.4201660	0.49
1044.0622560	0.26
1045.4414060	1.18
1047.5212400	0.73
1048.2113040	0.39
1049.0583500	0.97
1050.6335450	0.14
1051.7624510	1.86
1052.7020260	0.66
1053.5146480	0.69
1054.8098140	3.43
1055.5402830	1.20
1056.7260740	0.62
1057.6678470	0.25
1058.2819820	0.19
1060.4522710	0.23
1062.7119140	0.89
1063.8347170	0.99
1064.5539550	0.27
1066.0919190	1.30
1066.8322750	0.74
1067.5158690	4.31
1068.6391600	0.49
1069.4307860	0.35
1071.7324220	8.08
1072.7048340	0.69
1073.8867190	1.25
1074.6956790	2.43
1075.4803470	0.41
1077.8303220	0.53
1078.6086430	0.46
1081.4370120	0.18
1082.6917720	0.19
1084.7316890	0.43
1085.5410160	0.93
1086.1674800	0.62
1087.7231450	1.83
1089.4382320	1.76
1090.0804440	1.11
1091.2274170	2.24
1092.1668700	2.40
1092.8580320	0.11
1093.8681640	0.56
1094.9376220	5.92
1095.7175290	1.09
1097.1469730	2.58
1101.4271240	0.37
1102.5207520	2.13
1103.2792970	0.86
1104.7551270	0.07
1105.8675540	2.86
1108.0524900	0.72
1109.0505370	0.57
1109.8063960	1.49
1111.8171390	2.13
1112.8405760	1.15
1113.5705570	0.86
1115.7004390	3.46
1116.9013670	2.68
1117.7503660	0.97
1121.4586180	0.97
1122.1840820	1.63
1123.9886470	0.62
1124.7010500	0.12
1125.9648440	1.60
1128.0793460	5.08
1128.8116460	0.23
1129.9021000	0.17
1131.4658200	3.31
1132.2700200	2.45
1134.1104740	0.55
1134.9699710	2.64
1135.7604980	0.13
1139.0499270	0.41
1139.6612550	0.19
1140.6441650	0.07
1141.5356450	0.41
1142.5728760	0.99
1143.9318850	1.80
1145.3706050	0.30
1146.8773190	1.22
1147.7193600	2.62
1149.7839360	0.96
1150.8570560	0.32
1152.6242680	1.10
1153.8237300	4.48
1156.4145510	0.80
1157.4342040	2.30
1158.1196290	0.20
1160.5732420	4.92
1161.3489990	1.67
1162.1538090	0.73
1163.8582760	1.04
1165.7185060	0.34
1166.6555180	0.58
1168.1069340	0.55
1168.8303220	0.07
1170.0130620	0.63
1170.9515380	0.64
1171.8387450	0.46
1172.5201420	0.07
1174.7058110	0.25
1176.6958010	0.14
1178.3585210	0.07
1179.4992680	0.72
1181.7247310	0.11
1182.8587650	1.03
1183.9995120	2.40
1185.3847660	0.60
1187.8471680	1.11
1188.5520020	0.18
1189.7146000	0.14
1191.6287840	0.21
1194.2203370	0.19
1195.4674070	0.81
1196.6552730	1.05
1198.2054440	1.11
1198.8895260	0.34
1200.8752440	0.59
1201.7735600	0.51
1202.6333010	0.08
1204.2495120	2.54
1205.0911870	0.22
1206.6538090	0.76
1207.7458500	0.17
1215.2606200	0.14
1215.8801270	0.63
1217.3103030	0.77
1223.4169920	0.30
1224.2304690	0.42
1225.8864750	0.68
1226.7683110	0.88
1228.4005130	1.39
1229.3770750	0.85
1231.5444340	0.36
1232.2357180	0.80
1233.2789310	0.37
1234.6804200	0.86
1235.3787840	0.27
1236.1036380	0.60
1237.8273930	0.52
1239.0810550	0.33
1239.7392580	0.22
1241.0083010	1.61
1242.0509030	2.80
1242.7087400	1.69
1244.8756100	0.33
1245.7971190	3.64
1246.7915040	0.83
1249.1296390	0.19
1251.7944340	0.72
1252.7412110	0.55
1254.5737300	1.08
1255.8641360	0.35
1260.1947020	0.10
1262.6176760	0.57
1263.7961430	0.19
1265.1782230	0.28
1265.8535160	0.66
1267.5377200	0.50
1269.1485600	0.53
1276.6843260	0.85
1277.5612790	0.50
1279.3449710	0.26
1280.5382080	0.90
1282.1757810	0.90
1283.1820070	0.74
1284.6535640	1.17
1285.9614260	1.70
1286.6591800	2.77
1287.3146970	0.17
1289.0633540	1.11
1291.2457280	0.62
1292.7923580	0.28
1294.3505860	5.11
1295.0944820	1.51
1295.9217530	0.14
1299.2999270	0.95
1299.9570310	0.28
1300.9254150	0.15
1303.2344970	0.61
1305.1551510	0.17
1310.7709960	0.43
1312.2064210	0.69
1314.0841060	0.33
1314.8065190	0.13
1316.2152100	0.29
1320.9038090	0.11
1321.7144780	0.18
1323.2424320	0.07
1324.1092530	0.42
1325.7847900	0.84
1326.5985110	0.08
1327.4002690	0.08
1329.1544190	0.11
1330.6685790	0.92
1331.5162350	0.37
1332.4920650	0.56
1335.1984860	0.25
1337.6059570	2.48
1338.3945310	1.00
1339.3577880	1.13
1340.4393310	0.26
1341.0720210	1.28
1341.8104250	0.94
1342.5490720	0.29
1343.2901610	0.30
1348.6739500	0.45
1349.3991700	0.25
1355.9423830	0.11
1356.6770020	0.27
1358.4466550	1.28
1359.9941410	0.36
1363.6910400	0.72
1365.1789550	0.08
1369.5820310	0.47
1373.4129640	0.16
1377.5948490	0.41
1379.8563230	5.58
1380.8050540	0.64
1382.1448970	0.16
1383.7636720	0.16
1384.5518800	0.28
1391.8725590	0.84
1400.6717530	1.64
1402.6159670	0.57
1404.7880860	0.59
1405.9176030	0.77
1410.8535160	0.60
1416.6715090	0.05
1431.2283940	0.75
1433.1512450	0.44
1440.4857180	0.77
1450.1567380	0.36
1473.6966550	0.14
1477.2032470	0.29
1477.8283690	0.09
1485.7612300	0.11
1492.6170650	0.17
1494.1871340	0.34
1494.9683840	0.88
1496.8619380	0.18
1498.0173340	1.59
1499.3306880	2.37
1504.8630370	0.29
1509.5853270	0.20
1513.5701900	0.54
1514.2908940	0.20
1518.6207280	0.16
1519.3531490	0.28
1520.4198000	0.28
1528.3729250	0.40
1530.6710210	0.15
1547.6583250	0.17
1548.3101810	0.90
1549.9097900	0.29
1550.9449460	0.34
1552.6947020	0.32
1580.8942870	0.33
1586.4686280	0.08
1592.7979740	0.14
1594.8502200	0.21
1597.1234130	0.26
1608.5247800	0.10
1610.0621340	0.09
1612.2333980	0.18
1622.7943120	0.52
1630.5158690	0.24
1631.9360350	0.46
1633.8385010	0.21
1650.1594240	0.35
1658.7141110	0.15
1661.2672120	0.06
1694.3909910	0.07
1702.3531490	0.21
1706.2868650	0.18
1712.0531010	0.18
1723.2694090	0.19
1724.9631350	0.29
1741.5313720	0.15
1743.7850340	0.18
1752.9891360	0.20
1756.3194580	0.19
1759.1927490	0.07
1766.0914310	0.42
1768.1885990	0.26
1775.1022950	0.24
1775.9388430	0.24
1777.3070070	0.14
1778.2227780	0.05
1783.9473880	0.07
1784.8314210	2.95
1794.8697510	0.14
1803.8068850	0.13
1824.5203860	0.19
1826.7691650	0.24
1843.8758540	0.30
1845.7634280	0.10
1852.6076660	0.96
1872.1907960	0.08
1883.0651860	0.17
1894.8908690	0.14
1923.5137940	4.54
1925.2144780	0.07
1940.8967290	0.43
1944.9178470	0.72
1953.9021000	0.12
1954.8712160	2.64
1956.0921630	7.57
1959.8918460	100.00
1960.9012450	0.37
1961.6979980	0.06
1965.6853030	0.26
1972.3800050	1.93
1973.2102050	1.48
1980.1473390	2.15
1980.8887940	1.90
1982.8243410	1.22
1984.0300290	0.11
1985.1395260	0.08
1986.0897220	0.46
1988.6112060	0.28
1996.5506590	2.87
1999.3859860	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	520.3389
Annotation	PC(18:2(2E,4E)/0:0)
Peak:m/z	Relative Intensity
139.2385864	0.05
165.9733582	0.19
184.0395355	78.38
185.2078705	0.05
227.1175537	0.08
239.2597961	0.21
258.1405029	0.12
261.0551758	0.09
264.3214417	0.18
268.2698364	0.06
274.8980713	0.16
283.4442749	0.04
291.8424072	0.07
309.4587402	0.09
315.4349365	0.08
335.3015137	0.04
337.3890991	0.12
338.6702271	0.02
349.3856201	0.04
363.3372803	0.05
379.4240112	0.61
390.3091431	0.05
395.4048462	0.10
398.8919067	0.28
402.2136230	0.09
405.2674561	0.03
409.2666016	0.05
414.2231445	0.06
438.3343506	0.07
448.3193359	0.05
455.1561890	0.04
457.2201538	0.13
459.8907471	0.38
461.7063599	0.14
463.7307739	0.13
471.3577271	0.16
474.1574097	0.16
484.9351807	0.09
492.1351929	0.07
502.4202271	100.00
503.4241333	0.43
511.7026978	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	306.0764
Annotation	Glutathione
Peak:m/z	Relative Intensity
96.8273468	0.05
98.9396439	0.42
100.1953888	0.16
100.8000488	0.05
116.0605698	0.10
120.0491333	0.13
127.0927887	0.14
128.0425568	8.76
130.1880493	0.08
135.2251740	0.03
142.9814148	10.01
144.1973877	0.47
145.1147919	0.68
145.9365845	0.52
153.3443604	0.07
154.8827515	0.08
160.0190430	10.75
164.1863708	0.06
166.3839264	0.48
167.2040405	0.29
169.1920013	0.05
171.1013794	1.36
176.9886169	10.05
179.0917511	9.47
183.0262451	0.16
185.0571136	1.08
188.3211212	0.05
192.2153473	0.17
197.1339417	2.23
203.1130981	0.13
209.3592834	0.84
210.1658630	4.50
210.9720154	0.05
213.0682983	1.74
215.2283325	0.09
222.2078552	0.07
226.3297424	0.15
227.1911316	0.53
228.1652832	0.60
230.9800110	1.15
236.0398865	1.04
242.2014771	1.24
243.3494263	0.46
244.4056396	0.39
245.2746582	0.06
246.2410278	0.06
246.9757690	0.05
254.1851807	97.99
259.6752930	0.59
260.4113159	0.35
261.1624451	0.20
262.1739502	0.38
263.2587891	0.12
267.9866028	0.35
269.0847778	0.17
270.1351929	0.16
272.0994873	100.00
277.1948853	0.05
285.2129517	0.73
286.1340027	0.79
287.4023132	6.72
288.2042542	58.14
289.2276306	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	500.92
Annotation	Unknow
Peak:m/z	Relative Intensity
158.9813385	2.72
198.9839325	0.38
217.0221405	0.23
228.9540100	0.89
273.0508728	50.81
385.1322021	0.12
386.8958130	100.00
387.5103760	0.26
409.7445068	0.11
426.7843933	0.05
428.2435608	0.05
443.6574097	0.03
453.7585754	0.01
455.2912598	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	616.9
Annotation	Unknow
Peak:m/z	Relative Intensity
199.1166687	0.06
200.1672974	0.05
228.9811554	0.26
229.9779968	0.06
230.7887421	0.10
273.0597534	8.31
273.9638062	4.85
275.0129089	3.79
386.9645386	17.53
387.9247437	13.53
389.0472412	12.84
403.9967651	0.06
442.9364624	0.04
459.0056763	0.47
461.2070312	0.17
462.1956177	0.05
500.9704590	42.54
501.9325562	100.00
502.8978271	96.15
503.5036011	0.27
514.3565063	0.04
515.2713623	0.06
542.8124390	0.06
570.3817139	0.10
571.2686157	0.14
572.0240479	0.27
572.8626709	0.38
589.0640869	0.12
599.2318726	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	323.1231
Annotation	Melicarpine
Peak:m/z	Relative Intensity
97.8634033	0.09
130.1514130	0.17
169.0467834	0.06
240.9605103	0.16
245.1801147	0.05
248.3199768	0.04
259.1112671	0.06
263.1302795	0.35
266.1557007	0.07
275.6290894	0.05
277.0944824	0.06
279.1560974	0.04
287.5160828	0.29
289.2337341	0.13
306.0963745	100.00
308.0248413	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	340.06
Annotation	Melicarpine
Peak:m/z	Relative Intensity
113.0336609	0.04
114.9642868	5.32
116.1081696	0.11
122.9177780	0.08
127.1670227	0.11
129.0078125	0.18
139.0029907	0.24
157.0337982	3.50
159.8886108	0.05
167.0518799	0.05
171.0853271	4.03
172.1639709	0.63
173.8903503	0.10
174.9694214	100.00
177.2653198	0.04
181.3003540	0.11
183.3101196	0.09
185.0484314	0.12
186.0932465	0.04
192.9178772	0.15
200.1915894	0.34
202.3201294	0.07
204.1157837	1.35
210.3509827	1.29
210.9601746	10.52
214.0864868	0.12
224.2574158	0.04
231.3909302	0.07
240.0570374	0.06
242.0924072	1.09
244.0925293	45.61
253.0271606	0.04
254.2131958	0.19
255.4570618	0.09
256.1943359	0.28
260.0267334	0.21
263.2737732	0.04
264.7922974	0.07
272.1273804	10.54
273.0435181	2.49
274.1213074	1.75
275.1296082	0.05
277.2453003	0.23
278.0683289	0.05
286.1481323	3.48
293.0466309	0.11
294.2925720	0.10
295.3052673	0.13
296.0503540	0.22
297.0535278	0.04
303.9142151	93.93
304.9139709	0.62
306.0990906	2.03
307.1088257	0.28
308.5352783	0.19
309.3499451	0.04
319.1447449	0.09
321.1849976	0.68
322.0486145	0.69
324.4068909	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	465.2705
Annotation	Unknow
Peak:m/z	Relative Intensity
135.1526337	0.09
152.8902893	0.05
168.9992218	0.16
179.0496521	0.14
181.2670288	0.35
182.8554077	0.16
191.0061035	0.06
195.2353973	0.46
199.0843201	0.23
209.2259064	0.19
211.2827759	0.29
213.2703247	0.04
227.3114929	0.12
237.2522583	0.04
239.3348846	0.50
241.4993744	0.12
243.0775146	0.08
249.4421387	0.08
253.1296692	0.12
255.1187744	0.33
257.2659302	3.84
263.2345581	0.46
265.3708191	0.09
267.3123779	0.03
269.3720093	0.18
271.3616638	1.17
273.3017273	0.14
279.1656189	0.18
281.4470520	0.26
283.3857422	0.16
284.3175964	0.10
285.2795410	4.79
287.3556519	3.00
296.4624023	0.14
299.2780762	7.50
301.3672791	1.93
302.3347778	1.56
303.3873901	100.00
304.4629211	0.26
306.1048889	0.20
309.3910828	0.13
311.4571533	0.07
327.1728516	0.58
329.4980469	0.28
339.4349976	0.22
341.2839966	0.08
345.2339783	3.54
346.0169678	0.17
350.2775269	0.21
355.6162415	0.07
357.2596130	0.96
359.3515625	0.04
361.4730225	0.11
367.0446167	0.22
369.1419678	0.37
374.9659424	0.03
377.6498413	0.12
379.2858582	0.19
389.3134460	0.11
392.9218445	0.10
401.1838684	0.23
402.2716980	0.28
403.2724304	0.11
405.1240234	0.13
407.0430298	0.05
417.1164856	0.04
419.0721741	0.30
420.9091492	0.80
421.5528870	0.25
427.3068848	0.49
429.6012878	0.12
434.6799622	0.11
435.4609680	0.18
446.6818237	0.31
447.3109131	0.30
455.9627991	0.21
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
76.84547424	0.25
77.91281128	0.25
82.9408493	0.11
84.93157959	0.20
96.81420898	0.24
109.0468903	0.52
109.9155273	0.15
114.0911407	0.33
122.8695374	0.51
128.2462616	0.09
129.0895081	0.63
129.8825836	0.32
137.5675659	0.21
139.0065765	0.10
142.1653595	0.21
145.9697876	0.49
146.9477997	0.43
149.9685364	0.09
150.9430237	10.48
152.0336914	1.83
153.1915436	0.37
154.11586	0.30
161.1767273	0.73
163.2282867	0.58
164.0706635	0.15
166.1684875	0.07
167.9729156	0.58
169.176178	0.63
175.954834	0.53
177.8953094	0.37
179.6264038	0.78
182.7103577	0.47
184.1530304	0.28
185.1813965	0.09
187.0719299	0.19
193.9949188	0.47
194.8556061	0.25
195.9562531	0.09
197.0577393	0.69
197.9277802	0.87
206.0359955	7.87
207.7663116	0.81
208.8490295	0.54
211.397995	0.26
212.0888977	0.28
213.0671539	0.32
217.157074	1.04
218.127182	1.39
218.976944	0.76
222.4574127	0.35
225.2128754	1.78
226.2170563	1.01
235.4650116	3.73
236.1129761	14.34
236.9912872	0.78
238.2401733	2.63
239.6693573	0.98
240.5099945	0.37
251.1419525	0.14
253.0850983	100.00
254.0847168	6.18
255.0191193	0.42
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	353.0874
Annotation	Chlorogenic Acid
Peak:m/z	Relative Intensity
107.1448975	0.10
107.973465	0.06
109.0247116	0.02
110.9686737	0.03
126.8798599	0.13
132.1873016	0.02
133.1629791	0.01
134.088089	0.13
135.0576782	6.50
136.1005554	0.94
137.0129089	0.01
143.1689148	0.09
155.140213	0.21
160.0656281	0.01
161.0885925	0.93
162.1567535	0.22
171.0763092	0.07
173.0783081	2.77
174.1152649	0.44
175.2303162	0.05
179.0622711	38.47
180.0673981	6.46
189.2526398	0.01
191.0500793	100.00
192.0211487	11.93
193.1571198	0.03
206.9681702	0.04
216.0323181	0.08
216.9938049	0.01
219.2217102	0.04
222.1261597	0.02
233.4224854	0.01
246.0134277	0.01
266.1617737	0.01
281.3623047	0.02
290.1893311	0.02
291.5179749	0.01
309.4371033	0.07
325.1325378	0.12
333.338501	0.01
335.1059265	0.21
336.199585	0.22
337.2240601	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	438.9792
Annotation	Unknow
Peak:m/z	Relative Intensity
174.7239685	0.04
176.9209595	0.53
177.6538849	0.11
237.0449677	0.32
243.2511597	0.09
246.9112244	0.06
260.8608398	0.18
268.0853271	0.22
270.8877563	0.96
272.5568237	0.23
275.8373718	0.98
277.0288086	0.41
286.8330688	0.23
288.8461304	0.08
296.8943481	0.30
304.8295593	2.32
305.9812012	0.10
307.0229492	0.80
308.6375122	0.06
309.2497559	0.98
310.4216309	0.13
314.8602905	1.31
316.9343567	0.05
321.1808167	0.71
322.0628662	0.06
332.9409180	7.27
334.9981689	1.04
338.7439270	0.37
342.6393738	0.26
343.2516479	0.15
348.8482056	0.42
359.1147461	0.31
360.9496765	0.09
372.3081055	0.25
374.2817383	0.05
375.4223328	0.11
376.9582825	5.15
378.9809570	0.24
385.2171631	0.33
392.7145691	0.15
393.9704895	4.75
395.0506592	8.54
403.0143127	7.75
420.9264526	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	541.113
Annotation	Larixinol
Peak:m/z	Relative Intensity
171.3012695	0.05
175.2196350	0.03
192.0786438	0.02
203.2135468	0.06
210.1327820	0.06
236.9605713	0.02
254.1958466	0.33
260.4172974	0.03
261.1123657	0.04
272.1611328	0.67
273.0842285	0.09
286.1406250	0.17
293.2927246	0.04
295.0825806	0.02
304.2106934	2.40
305.5515137	0.42
306.2659912	1.18
307.1878662	0.41
319.0703125	0.05
323.1372681	0.08
327.6006470	0.04
331.3236694	0.03
333.1583862	0.05
337.5845947	0.09
343.2031250	0.30
345.2525024	0.13
355.2597656	0.04
361.9115601	0.03
362.6189575	0.05
368.4952393	0.09
376.2112427	0.07
378.2403564	0.17
380.8645630	0.23
403.1395874	0.02
405.3706665	0.03
419.4771729	0.05
420.2331543	0.09
424.7974854	0.03
425.4242554	0.05
435.1549683	0.03
440.1195679	0.12
442.2898560	0.03
445.5033569	0.02
452.2632446	0.08
453.2211304	0.08
454.1243896	0.03
455.3141479	0.43
462.3941040	0.02
463.3243408	0.81
465.0728760	0.07
469.2218018	0.03
474.1845093	0.04
476.9152222	0.08
493.3142090	0.02
495.0823364	0.40
497.2881470	100.00
502.9293823	0.03
504.2640381	0.04
505.4098511	0.21
511.5172119	0.09
521.2292480	0.08
522.1598511	0.13
523.1671753	0.19
524.3201904	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	626.2106
Annotation	kappa-Lactone
Peak:m/z	Relative Intensity
179.1660461	0.18
185.2728271	0.29
227.2708740	0.34
231.0571594	0.29
277.1369629	0.17
282.0855713	0.12
288.1893311	0.72
299.3101196	0.21
303.2095337	0.25
308.1113281	0.31
318.3026733	0.11
335.0902100	0.30
363.1162720	0.09
394.0356445	0.13
410.0806885	0.06
415.3405151	0.12
425.2734375	0.16
427.9542847	0.44
437.0122070	0.86
442.3355713	0.05
445.1833496	0.24
462.0446777	0.60
464.3098755	0.06
470.6338501	0.19
475.7979736	0.07
476.4476929	0.45
477.3374634	0.32
479.2168579	14.12
480.3745117	0.94
483.6926880	0.28
488.2799683	0.44
497.1070557	2.91
497.7124023	0.22
499.3524170	0.07
505.1936646	0.20
506.3921509	0.17
514.5645142	0.23
519.3427124	0.53
520.8701172	0.10
533.2352905	0.15
534.2042847	0.36
540.7643433	0.41
548.2659912	0.26
551.3331299	0.49
553.9136353	0.31
561.9917603	0.16
563.4278564	0.81
566.7481079	0.61
568.8562622	1.56
577.0866089	0.04
578.3557739	0.43
579.5400391	0.57
580.8511353	0.21
583.3998413	0.43
589.7105713	0.42
591.2234497	0.94
592.0261230	0.77
595.8481445	2.43
596.6808472	1.69
597.4746094	0.11
600.2300415	0.24
604.3253784	0.10
605.2816772	0.36
606.9219360	0.24
608.2370605	100.00
609.1506958	3.41
610.3587036	0.66
611.7633667	0.38
613.9392700	0.18
616.3622437	1.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	299.2595
Annotation	DL-2-hydroxy stearic acid
Peak:m/z	Relative Intensity
95.0727005	0.20
97.08929443	0.11
113.1650696	0.29
124.9294052	0.24
127.0829391	0.10
136.7888336	0.18
138.8180237	0.10
149.0839233	0.16
150.9824829	0.17
158.1479034	0.40
181.0634918	0.16
183.0480499	0.35
185.0354614	1.16
186.0943909	0.35
197.0231781	0.39
197.6606903	0.08
199.2214355	0.69
210.8353271	0.47
213.2739563	0.09
215.0798035	0.44
219.2429504	0.35
225.0485535	0.96
227.2056274	0.40
235.078064	0.26
237.2405396	2.58
239.217926	1.20
240.9450684	0.51
244.2740173	0.10
247.1999512	0.30
251.1373291	0.63
253.2524109	100.00
254.4397583	3.75
255.3504333	4.24
256.2758179	0.14
257.6352234	0.54
261.3564453	0.16
263.3604126	2.28
267.4962158	0.13
269.3111877	0.25
271.2713623	0.47
281.2255859	12.64
283.0983887	4.21
284.104126	0.33
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	763.2141
Annotation	Unknow
Peak:m/z	Relative Intensity
222.9062500	0.09
245.3568878	0.10
258.9580078	0.07
263.1180115	0.06
281.2377625	0.14
289.1913147	0.05
298.9498901	0.03
300.0631104	0.11
307.1800842	2.39
323.2816772	0.07
325.0921631	1.55
341.1486816	0.04
348.8546753	0.20
390.0103760	0.06
401.1828613	0.12
409.3908691	0.03
420.8400269	0.02
422.2548828	0.55
423.2702637	0.04
424.0912476	0.04
431.0254517	0.04
437.2576294	0.08
439.1378784	1.61
440.5542603	0.05
449.4764404	0.08
463.0291748	0.09
467.1031494	0.10
475.0403442	0.06
481.2384033	0.22
493.2646484	1.35
494.1224976	0.07
496.1304932	0.15
499.2526855	1.39
509.2182007	0.06
511.2993774	2.04
523.2587891	0.10
527.3037720	0.02
529.2701416	0.32
534.9905396	0.22
541.2609863	0.48
553.1976318	11.02
553.8973999	0.05
571.2589722	14.73
571.8599854	0.13
587.2816772	0.03
589.3005981	0.71
595.1109009	0.79
601.1126099	0.03
607.3619995	0.07
613.2004395	1.79
613.8591919	0.04
625.3684082	1.88
627.1542358	0.26
631.2320557	33.00
631.8452759	0.08
632.6078491	0.08
643.2593384	3.60
655.2234497	0.04
661.4553833	1.26
665.2404785	0.67
667.2270508	0.50
673.3244019	1.92
674.2405396	0.03
674.9119263	0.03
685.3332520	37.58
703.2951050	100.00
715.1234741	0.03
721.3451538	4.21
727.3217773	0.16
744.2116699	0.03
745.3733521	0.51
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	311.04
Annotation	Unknow
Peak:m/z	Relative Intensity
156.8951874	0.29
175.1097565	100.00
206.0961914	0.19
212.9787292	10.95
227.1246033	3.32
242.7385864	0.61
253.0468750	0.35
264.1368408	0.18
265.3306274	0.46
292.9510803	1.45
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1094.8472
Annotation	Unknow
Peak:m/z	Relative Intensity
307.0398254	0.02
317.8056335	0.13
348.1478882	0.02
384.0076904	0.03
416.6450500	0.06
446.7153015	0.08
488.8968201	0.01
504.9129333	0.03
509.2927856	0.06
524.7233276	0.01
527.8227539	0.18
568.8836670	0.09
571.3516846	0.02
599.6043701	0.10
608.7368774	0.10
609.3816528	0.05
626.0374756	0.01
629.9505615	0.03
659.4356079	0.12
669.4787598	0.04
671.2003784	0.03
672.3019409	0.01
678.4494629	0.06
680.8754883	0.38
689.8613281	0.17
690.5161133	0.10
713.0982056	0.01
731.2941284	0.03
741.3442383	0.19
750.5596924	0.56
751.3947754	0.05
762.1779785	0.18
770.8430176	0.39
771.5284424	0.12
803.3468018	0.02
813.0633545	0.01
822.7149658	0.04
826.7243652	0.01
831.3317871	0.52
831.9378662	0.05
833.3618164	0.08
834.2930908	0.15
843.0098877	0.78
843.6779785	0.23
851.7864990	0.41
852.5301514	0.14
882.5639648	0.07
892.7293701	0.04
893.4100342	0.43
894.2484131	0.06
903.4451904	0.04
912.3513184	0.43
912.9841309	0.21
923.5877686	0.80
924.4726562	0.63
933.0064697	0.78
933.8405762	0.02
954.4704590	0.03
963.5139160	0.04
984.7593994	0.37
993.3562012	1.85
994.0297852	0.87
995.1093750	0.03
996.0435791	0.09
1000.2597660	0.03
1005.2701420	1.07
1013.0111080	0.12
1014.3771970	0.27
1020.0646970	0.05
1026.0509030	0.09
1035.8759770	0.05
1045.0095210	0.24
1055.4283450	0.05
1056.5878910	0.11
1076.8911130	0.24
1077.8791500	0.09
1115.3925780	0.03
1123.7336430	0.03
1155.9276120	0.06
1157.2216800	0.14
1186.9492190	0.03
1218.6644290	0.03
1300.2113040	0.03
1301.4162600	0.03
1319.4017330	0.14
1336.5168460	0.05
1379.4230960	0.05
1380.4039310	0.07
1409.1672360	0.02
1481.1123050	0.02
1571.4447020	0.05
1700.0080570	0.04
1702.6990970	0.03
1703.6218260	0.04
1704.6130370	0.04
1711.9777830	0.06
1722.0311280	0.05
1756.8448490	0.02
1797.4781490	0.64
1805.6241460	0.03
1806.2489010	0.05
1825.5965580	0.38
1838.8048100	0.02
1846.6232910	0.08
1851.8961180	1.02
1855.6397710	0.28
1860.0235600	0.02
1869.6646730	0.16
1871.7315670	0.34
1874.8917240	0.07
1883.4635010	0.09
1885.6521000	0.02
1887.4079590	0.02
1892.2391360	0.15
1893.0548100	0.04
1897.2476810	2.56
1898.7269290	0.02
1907.1175540	0.02
1913.3424070	0.09
1915.6239010	0.23
1916.2399900	0.01
1917.4454350	0.12
1919.4494630	0.09
1921.3575440	0.02
1922.0577390	0.15
1923.4329830	0.06
1924.9976810	0.94
1928.2218020	0.02
1930.5935060	0.06
1932.5653080	0.02
1937.2481690	0.03
1942.5118410	0.03
1946.0543210	1.53
1952.8975830	0.04
1954.6901860	0.03
1956.7000730	0.17
1960.2844240	0.02
1961.9664310	0.05
1965.1260990	0.88
1967.7009280	0.15
1971.7111820	0.04
1974.4143070	0.03
1978.0023190	2.84
1982.2736820	0.02
1984.0443120	0.08
1985.2681880	0.04
1986.0604250	0.96
1988.1907960	1.64
1988.8508300	0.06
1989.6829830	0.31
1991.4722900	100.00
1992.2052000	1.08
1993.7344970	0.18
1994.8983150	0.29
1995.6408690	3.09
1998.2814940	0.03
1999.2542720	0.20
1999.9991460	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	441.1435
Annotation	Unknow
Peak:m/z	Relative Intensity
134.2178802	0.08
134.9658508	0.03
149.8710175	0.03
174.1539612	0.09
179.3120117	0.03
180.1861420	0.09
186.9705505	0.09
193.0717926	0.28
193.9779968	0.23
195.1789246	0.15
196.1322021	0.14
199.1401367	0.75
201.1096344	0.09
222.1827240	0.03
228.2252045	0.04
235.5302277	0.12
239.8164368	0.13
241.1428833	0.04
243.1503906	0.07
245.0770264	0.05
246.0323792	0.09
247.2915344	0.05
254.1197815	0.10
259.1332703	0.67
261.1573486	0.18
262.2659607	0.06
264.5828247	0.24
265.2752075	0.17
267.0335388	0.23
268.3226624	0.05
271.9536133	0.14
274.2738647	0.03
274.9763489	0.08
277.2236633	0.05
279.1108398	100.00
280.1005249	0.10
293.4282227	0.10
294.4376831	0.08
295.1431885	0.07
296.1197510	0.06
300.2851562	0.03
301.5565186	0.20
304.1537476	0.13
304.9086609	0.05
306.1623840	0.13
315.1035461	0.13
321.1015625	0.79
322.3462830	0.55
323.2288208	0.15
331.2667236	0.11
334.0882568	0.23
336.1813965	0.17
339.3984070	0.10
345.1399231	0.46
346.3042297	0.03
351.0450745	0.20
352.2623901	0.14
353.3382568	0.12
355.3831177	0.26
360.3175659	2.58
361.2541809	0.44
362.2470093	0.18
363.3768005	0.04
369.1893005	0.10
378.4032288	0.11
379.4294434	0.12
380.3120117	0.36
381.5101624	1.01
382.3819885	0.22
383.1913757	0.08
394.5855713	0.18
395.3418884	0.34
396.2941895	0.36
397.2055664	0.65
403.0953369	0.28
405.3881836	0.22
406.4007568	0.22
407.3453064	0.04
421.4536133	0.17
422.1116638	0.66
423.1708679	0.46
424.3128357	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	649.1004
Annotation	Oxidized glutathione
Peak:m/z	Relative Intensity
182.9476013	1.08
197.2898865	0.18
207.0007019	0.32
214.8192749	0.25
217.1545868	0.28
219.1952515	0.26
222.2288208	0.58
223.0213470	1.18
231.0850677	0.33
232.0908508	0.45
234.1135559	0.52
234.9498291	1.87
237.0390167	1.61
239.1816711	0.29
247.8796234	0.36
252.0987549	5.04
254.1999207	0.71
257.0479431	0.84
264.1784668	0.16
266.2098694	1.48
269.0379333	1.50
272.0028687	1.47
286.1327515	0.22
288.2331238	0.60
292.0507202	4.27
297.9768677	0.42
300.7236938	2.46
304.1574707	0.59
306.1093750	7.50
310.1056213	18.99
324.4402466	0.38
334.2227478	0.18
338.1495972	6.18
342.0993652	100.00
344.1450195	64.07
376.1353149	42.80
391.2063599	0.47
399.3829346	1.36
438.8611450	0.59
463.0057983	1.16
497.3616943	0.19
502.1151123	1.42
507.9786987	0.32
520.2239380	48.75
520.9007568	0.31
546.9655151	0.68
556.1855469	0.19
564.9607544	0.47
565.8690796	0.54
605.0358276	0.33
613.1824341	0.68
630.6111450	3.50
631.2502441	44.39
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	266.0339
Annotation	Unknow
Peak:m/z	Relative Intensity
85.9721985	0.86
86.9601440	0.32
97.7549133	0.04
113.8859100	0.03
116.2186279	0.03
122.9593353	0.32
132.9055634	0.07
140.0426941	3.30
149.9770660	4.03
150.5791626	0.06
158.1279755	0.18
166.0658417	0.11
184.0130615	3.00
185.8896790	0.45
202.0223999	34.26
203.6080475	0.09
230.0771027	1.21
237.1820068	0.03
247.9736328	100.00
248.7715607	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	571.2408
Annotation	TMC 2A
Peak:m/z	Relative Intensity
267.8378601	0.07
313.2525635	0.43
315.0742798	0.05
336.2254028	0.07
343.9537964	0.17
364.6422729	0.02
372.9438477	0.11
377.4370117	0.03
381.3973999	0.08
383.1616821	0.04
391.0528564	0.04
395.3235474	0.27
397.0599976	0.33
398.1181030	0.27
407.2102051	0.05
409.1463623	0.06
419.3245239	0.06
440.1217651	0.66
441.3132324	24.78
442.0994263	100.00
442.9352417	0.09
444.8888550	0.06
452.9488525	0.08
454.3037109	0.19
455.2211914	0.07
463.2565918	0.05
467.2337646	0.06
473.0222778	0.36
473.6950073	0.06
475.4457397	0.03
478.3721924	0.22
489.7660522	0.20
490.9777222	0.37
506.1192627	0.10
507.2312622	0.05
528.7858276	0.19
553.0920410	0.31
569.6795654	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	206.89
Annotation	Unknow
Peak:m/z	Relative Intensity
122.9033966	100.00
123.9352112	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	685.277
Annotation	Unknow
Peak:m/z	Relative Intensity
385.0693359	0.52
446.2704468	0.33
453.0305176	0.26
482.2864380	0.43
520.3307495	100.00
522.5161133	0.61
587.2775269	0.49
668.2511597	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	329.0698
Annotation	Cabbage identification factor 2
Peak:m/z	Relative Intensity
175.0170898	0.10
186.9778900	0.09
191.1954956	0.15
199.1821289	0.23
202.1292419	1.41
217.1855774	0.06
226.0430908	1.63
251.0648193	0.20
253.4544983	0.57
254.0982666	3.08
255.0975342	0.05
256.2003479	0.30
265.1247864	0.18
272.0389709	6.00
272.6893005	0.17
277.8500671	0.05
283.0827637	100.00
284.0576172	6.93
285.0349426	0.20
292.4393311	0.17
293.2169189	0.16
306.0981445	0.07
308.1388245	0.12
311.1139832	1.69
312.7032776	0.12
320.2425842	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.0711
Annotation	7-Hydroxy-3-Methylflavone
Peak:m/z	Relative Intensity
104.8153992	0.14
116.877121	0.72
127.0968933	0.16
133.0014191	0.31
143.0197906	0.39
144.6616669	0.18
145.9927979	0.44
147.0581512	0.14
149.0315094	3.19
149.8917236	0.50
153.0342255	0.18
165.1189423	0.56
166.0360413	0.19
168.1839294	0.16
173.9768219	0.43
175.6805878	0.63
179.0666046	2.14
180.0887299	1.46
181.0884094	1.08
182.0603027	0.21
182.978775	0.18
192.9546356	0.59
194.0431061	0.48
195.3541565	0.50
196.2523956	0.16
204.2268829	0.14
204.8907623	0.10
206.108902	2.06
207.0289001	9.15
208.1222076	10.65
209.038269	3.87
210.1303864	0.50
210.7870483	0.11
222.0469208	6.61
223.1004333	16.34
224.1438446	6.60
233.6938324	0.70
236.0047607	0.64
249.1196442	0.15
251.0678101	100.00
252.1543427	57.97
253.1721191	4.77
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	516.8975
Annotation	Unknow
Peak:m/z	Relative Intensity
158.9514008	0.54
174.9024353	0.54
198.9215698	0.07
229.0083466	0.25
245.0471039	0.02
272.9865112	6.61
288.9840698	9.17
386.9492798	0.92
401.3146362	0.08
402.9057007	100.00
403.5288086	0.44
426.8587036	0.03
442.4867554	0.02
443.1580811	0.08
459.1871338	0.02
469.7907104	0.28
470.8876343	0.90
473.0609741	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	279.12
Annotation	Unknow
Peak:m/z	Relative Intensity
79.7925720	0.17
96.8224640	100.00
108.7623978	0.31
123.8929214	0.11
136.9323120	0.55
139.0394897	11.19
168.1945648	0.42
168.9537201	1.55
177.2630463	0.17
181.1924591	0.08
187.0166931	0.18
195.0817261	0.09
197.2736511	0.11
199.1140442	80.69
200.1212769	0.17
205.1250000	4.42
217.0356445	0.10
230.9523621	0.10
233.0062866	0.07
235.1891479	26.82
249.1688538	3.77
261.1575012	0.92
262.1404724	0.32
279.2251587	0.37
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	369.1105
Annotation	(S)-N-[3-(3,4-Methylenedioxyphenyl)-2-(mercaptomethyl)-1-oxoprolyl]-(S)-alanine
Peak:m/z	Relative Intensity
127.9643478	0.04
130.0391235	2.05
131.1070251	0.04
132.8548889	0.04
146.1524200	0.06
148.2680969	0.06
148.9430389	0.03
155.1176147	0.06
156.1774597	0.21
162.0937195	1.04
170.7065125	0.09
172.0521240	0.16
173.2773132	0.30
174.0672302	1.53
189.0668945	1.10
189.9391785	0.52
191.0928345	0.02
201.1434326	0.16
204.0802612	0.03
205.1433716	0.25
207.0185699	100.00
207.6260071	0.33
212.1498413	0.03
214.9458618	0.02
217.0848694	0.16
219.2191467	0.12
220.1816101	0.02
223.9309387	0.01
226.0967102	0.08
227.0089111	0.12
228.0320435	0.02
231.0549622	0.12
235.2958679	0.05
243.9666443	0.04
249.0730286	2.50
254.0241394	0.03
255.1639404	0.15
256.1418457	0.08
269.1457825	0.04
273.1482544	0.12
274.1531677	0.11
275.1027527	0.02
277.0887756	0.10
280.1652222	0.03
281.2561646	0.06
282.0611877	0.18
285.1072388	0.09
288.7898865	0.01
291.0503540	0.02
292.2445068	0.27
297.4123535	0.01
313.3250732	0.04
315.1694946	0.51
317.1069946	0.06
317.9178772	0.10
323.2036438	0.02
325.1039124	0.02
326.7068787	0.03
327.3139648	0.20
328.0986023	0.02
333.0416870	0.81
334.0380249	0.12
335.4415894	0.16
336.1797791	0.26
337.1024780	0.02
338.0708618	0.03
339.1549072	0.04
341.8379211	0.21
350.5220032	0.24
351.1551819	1.34
352.1613464	3.86
360.3543396	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	402.9169
Annotation	Unknow
Peak:m/z	Relative Intensity
158.9267120	0.13
175.0161743	0.81
245.0083618	0.08
246.9961853	0.03
272.9942627	3.80
273.8763428	0.03
287.0919800	0.05
288.9291992	100.00
305.1067505	0.10
324.1677246	0.02
329.0263672	0.04
346.9748840	0.12
356.0570679	0.10
357.0876770	0.11
359.2217102	0.10
372.9980164	0.03
373.7921143	0.03
374.8686829	0.02
380.0348206	0.07
383.9630127	0.03
384.9128113	0.04
390.1174011	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	318.1554
Annotation	Unknow
Peak:m/z	Relative Intensity
97.9578476	0.18
111.9383850	0.98
113.1469345	0.20
113.7956390	0.40
115.0127945	0.37
130.1296082	0.79
139.2156982	1.79
140.1145630	0.72
141.0614929	0.46
143.9623718	13.24
145.0186768	0.58
153.0818481	0.18
157.0089417	10.88
158.1078491	34.62
161.0804443	0.30
175.1394501	57.64
185.7908325	0.11
201.1749878	3.25
239.3508301	2.51
240.2428894	2.12
242.7923889	0.14
255.0686035	0.24
256.1754150	0.54
257.5039673	1.60
258.2243347	21.19
259.1717224	2.89
268.8755798	0.12
272.2803650	1.02
273.9074707	0.08
278.0951233	0.10
282.8950195	4.27
284.0119019	2.28
286.4854736	0.79
300.1804199	100.00
301.2295837	87.39
301.9687195	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.0714
Annotation	Deoxyinosine
Peak:m/z	Relative Intensity
150.8501129	1.24
162.8637848	0.41
165.0959625	1.12
174.0128021	1.04
177.06633	0.65
180.0340271	0.69
181.2757416	1.52
182.914978	0.77
193.1583405	1.52
195.1586151	1.13
206.001236	3.52
207.1064301	17.61
208.0594788	0.89
209.1742554	6.56
214.8735352	3.78
221.1503754	0.49
222.0222626	3.46
223.1350098	9.52
233.1266632	3.64
251.079834	100.00
251.9516449	14.46
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	246.0982
Annotation	Valinopine
Peak:m/z	Relative Intensity
114.8876343	0.26
115.8360596	0.33
119.0036621	0.08
129.9962006	11.07
130.9491882	0.16
166.3613892	0.05
167.8509216	0.04
183.3492279	0.18
183.9516144	0.05
186.1189575	0.13
188.7719727	0.07
200.0264130	0.20
201.2285614	0.11
202.1864929	0.27
203.2172241	0.12
204.1515961	0.43
210.0806427	23.08
217.2081299	0.13
228.0394440	100.00
231.2886200	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	477.0641
Annotation	4-Methoxyglucobrassicin
Peak:m/z	Relative Intensity
141.1659241	0.05
145.0771179	0.22
154.0837097	0.85
168.9542236	0.16
172.8101654	0.41
173.9868622	0.09
186.0899658	0.15
187.8100281	0.11
193.2358704	0.10
203.2023926	0.36
205.0289307	0.58
210.1468658	0.26
224.0641937	1.30
226.2121887	0.06
235.2045746	0.22
241.1274567	0.54
243.9442291	0.06
250.2738342	0.08
251.2083130	0.17
252.2430725	0.06
255.9345093	0.16
258.9623413	2.78
269.4779663	0.07
272.5305176	0.16
274.6201477	0.15
275.2955933	0.36
278.5857544	0.11
282.9206848	0.23
284.0257874	1.93
285.1452942	0.85
286.0772400	0.16
291.0100403	1.24
295.3601074	0.11
296.4186401	0.20
297.2333679	0.08
298.2023010	0.12
298.9771729	0.39
301.4162292	0.30
306.1323547	0.53
307.0418701	0.14
311.0415039	0.07
313.2253418	0.25
315.0832214	0.26
326.0406494	0.05
341.0987854	0.07
347.2604065	0.20
361.3077698	0.18
367.4419861	0.12
389.2528381	0.12
395.1410217	0.13
403.4581604	0.08
412.4197083	0.13
413.0737610	0.09
416.0166626	1.07
417.5053711	0.05
419.5380249	0.06
430.1441040	0.14
431.1627808	0.28
433.4728088	0.55
440.3315735	0.07
441.0211792	0.16
446.0971985	100.00
447.1833801	72.08
459.1697693	0.56
459.9923401	0.12
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	564.3308
Annotation	Unknow
Peak:m/z	Relative Intensity
166.7187500	0.04
171.0758667	0.06
199.2110901	0.02
201.7864990	0.03
204.2834625	0.02
205.2886353	0.02
214.2941895	0.14
219.7984924	0.08
223.3046417	0.08
242.1179352	0.08
244.1269379	0.03
253.1109772	0.05
255.4059143	0.25
256.2442627	0.04
267.9913940	0.05
277.3610535	0.06
279.3176270	2.20
294.2048950	0.03
307.3591309	0.04
314.4219360	0.03
325.3928833	0.06
326.1882935	0.07
329.3221436	0.03
335.9255981	0.02
343.0975342	0.04
351.1524048	0.03
366.8595581	0.04
391.3114624	0.39
406.3036499	0.02
408.0085449	0.16
409.4178467	0.15
421.2655029	0.04
459.4816284	0.02
461.2781372	0.03
465.0646973	0.12
468.2055054	0.19
485.3122559	0.10
491.4320679	0.03
504.3353271	100.00
505.2836304	0.48
517.6134033	0.04
518.3240356	0.16
520.1410522	0.02
528.1429443	0.36
531.5924683	0.06
533.1862183	0.04
545.6029053	0.29
546.4370117	0.20
549.1310425	0.02
573.1834106	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	531.1091
Annotation	Unknow
Peak:m/z	Relative Intensity
161.1350403	0.11
161.9258270	0.60
164.1564484	0.01
174.9400024	0.08
181.0982361	0.07
189.1292267	0.10
195.2242432	0.04
207.1272125	0.49
247.2668610	0.13
249.5328674	0.04
254.1768036	0.03
279.2619019	0.06
281.0902710	0.22
282.5557861	0.08
283.1597290	0.07
286.0097046	0.04
287.2331543	0.03
305.1556396	0.02
315.3637085	0.06
324.2017822	0.07
330.1683960	0.06
331.5470581	0.09
332.2680054	0.21
339.3638306	0.03
342.1196289	0.06
343.1900635	0.03
351.1187744	0.69
352.1323242	0.08
352.9404297	0.04
355.3096313	0.04
357.2435913	0.17
367.2064819	0.07
368.1380615	0.12
369.1737671	0.90
370.0485229	0.09
373.4949341	0.17
384.0690918	0.03
385.2909546	0.04
392.4108276	0.18
398.0952148	0.12
398.9815674	0.09
399.7871704	0.10
400.7091675	0.10
401.4594727	0.12
403.2934570	0.08
410.0901489	100.00
411.2562866	0.06
411.9974976	0.06
422.7960815	0.10
424.7701416	0.02
429.1181030	0.08
434.3724976	0.04
440.3662720	0.03
442.3345947	0.15
444.1785278	0.35
449.7860718	0.09
452.8090820	0.25
458.0612793	0.05
464.7082520	0.05
467.3937378	0.18
469.5827637	0.40
473.3449707	0.09
477.2991943	0.07
485.0336914	0.05
486.9244385	0.10
490.1464844	0.20
494.7112427	0.03
495.3780518	0.07
496.3262329	0.04
498.6220093	0.28
499.3986206	0.18
512.1009521	0.16
513.1825562	0.43
514.1094971	0.06
518.6969604	0.15
521.2059937	0.35
523.2661743	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	709.1143
Annotation	Unknow
Peak:m/z	Relative Intensity
209.3721619	0.01
272.1528015	0.21
288.0807800	0.01
293.0790405	0.01
304.3072510	0.04
306.1110229	0.45
326.4493408	0.01
338.1449585	0.45
402.1801758	0.05
423.5416870	0.07
459.2509155	0.02
460.1295776	0.04
482.2023926	2.54
499.2239380	0.03
524.9820557	0.03
576.8978271	0.01
580.1737671	0.68
593.2232056	0.83
605.3825073	0.02
611.1830444	100.00
611.8602905	0.21
620.2506714	0.02
625.2661743	0.01
630.3326416	0.03
645.2064209	0.05
662.2402954	0.09
672.9285278	0.02
690.2312622	0.03
691.2313843	0.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	278.1053
Annotation	Metazachlor
Peak:m/z	Relative Intensity
87.9424591	0.32
92.9679489	0.06
104.6577759	0.02
110.9034576	0.03
112.1641541	0.02
113.0383148	0.11
120.0120544	0.34
120.7906189	0.07
121.9818878	0.39
123.1342163	0.04
125.1914139	0.07
126.7497787	0.04
129.9836426	0.14
130.7069550	0.03
132.1744995	0.01
133.1144714	0.02
137.0502930	0.02
139.0563660	0.28
143.1177979	0.11
144.8816528	0.01
146.0072021	0.04
148.0849609	0.07
150.3718872	0.07
151.1244507	0.02
152.9705811	0.05
161.8527374	0.09
163.7735596	0.01
165.0180664	0.15
166.2351532	0.02
170.0218506	0.11
171.0211182	3.03
171.8628082	0.02
174.0004120	0.15
175.2067871	0.02
178.1059265	0.09
180.1046448	0.09
186.1412506	0.11
187.0292053	0.03
188.0157471	0.17
188.8757477	2.16
190.0026093	0.26
196.1044006	0.07
196.7506104	0.03
197.8924561	0.03
198.9513550	0.06
200.9291382	0.03
202.1800232	0.10
203.4399414	0.06
204.1981201	0.01
208.2686462	0.31
214.1587830	1.73
215.0867310	0.44
216.0692139	0.10
217.0674744	0.30
219.2477722	0.05
220.1538696	0.12
221.2025757	0.02
221.8613586	0.03
224.3753052	0.28
225.1643677	0.17
230.9128723	0.77
232.0429382	1.76
233.2300110	1.35
234.1486511	1.27
235.2990112	0.59
236.3284912	0.08
242.0702515	13.12
242.9543152	1.88
244.0500488	0.03
247.0939941	0.04
249.2207336	0.03
250.0067749	0.05
260.0382385	100.00
260.9408569	4.76
269.7790222	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	245.0125
Annotation	Unknow
Peak:m/z	Relative Intensity
79.7960968	2.45
80.8493347	5.06
87.1082916	0.05
93.2163544	0.39
97.0119858	0.83
108.9453278	0.02
118.9903107	4.60
121.0021057	1.69
130.1339722	0.04
130.8396301	0.08
149.1201630	0.04
149.9147797	0.08
151.1431732	0.05
153.0905304	0.25
163.0447083	0.35
165.0156708	100.00
172.9770355	0.30
180.9291229	0.28
183.0240631	0.22
185.9190979	0.24
186.9355316	0.04
199.0918732	0.03
200.3146057	0.40
201.0973053	0.28
203.0959625	0.05
215.1151276	0.12
216.3204651	0.05
227.1537933	0.65
229.0929413	0.17
230.1224518	0.18
237.8662872	0.13
244.8302765	0.44
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	537.1645
Annotation	Unknow
Peak:m/z	Relative Intensity
193.0403137	0.33
202.9175720	0.09
273.0104370	0.10
334.9109497	0.29
343.2843628	0.42
368.2670288	0.13
389.2219238	0.07
438.7543945	0.22
441.3668213	0.15
449.1158447	0.24
451.2782593	77.38
470.3881226	0.29
475.1756592	0.54
489.1814575	0.07
493.2171021	100.00
494.1314697	1.07
497.9815063	0.12
507.5099487	0.47
518.3123779	0.08
519.2549438	2.83
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	526.76
Annotation	gamma-Pentachlorocyclohexene
Peak:m/z	Relative Intensity
182.9943848	0.06
190.4969635	0.07
206.7607117	0.36
223.1040039	0.11
274.8033447	2.67
278.4689941	0.10
290.8516846	7.74
306.9065552	0.25
351.0109253	0.59
351.8958130	1.24
352.8787231	1.11
358.7056274	11.23
362.5466309	0.76
363.2387695	1.22
369.1509399	0.28
370.9175415	16.72
371.8969727	0.34
372.9469604	0.04
374.6719360	7.67
380.2532349	0.15
389.7932129	0.35
390.7612305	0.27
437.3753662	0.20
440.1761475	0.46
441.0270386	0.61
442.1373901	22.65
442.7397461	100.00
457.8835449	5.04
458.7675171	3.39
479.9230957	5.48
480.9610596	0.81
499.1783447	0.09
500.1029663	0.07
508.4282837	0.09
509.0349731	0.19
528.2390747	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	613.157
Annotation	Glutathione, oxidized
Peak:m/z	Relative Intensity
177.007843	0.02
185.0291595	0.03
199.0566101	0.05
208.9638062	0.17
211.0318298	0.90
231.1749573	0.42
235.111969	0.35
253.0304871	0.02
256.1426392	0.04
257.223938	0.03
262.1397705	0.18
271.0365601	0.05
274.3417358	0.02
280.2452393	0.09
288.2711792	0.10
297.8522949	0.03
306.0646362	0.01
318.6181641	0.02
319.3605957	0.07
322.1854858	0.02
337.2327881	0.28
355.0693359	66.12
355.6824951	0.15
357.3955688	0.09
363.9557495	0.03
391.1453247	0.14
409.1715088	3.30
421.1413574	0.13
444.0604858	0.02
466.2404785	5.41
478.1885376	0.08
480.9603882	0.03
484.1176758	100.00
484.7537842	0.18
497.3070068	0.09
514.1216431	0.02
515.3910522	0.05
520.2978516	0.19
538.276062	2.74
548.9121094	0.05
549.9164429	0.11
577.1286621	0.26
595.2767334	21.41
604.0275269	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	565.0474
Annotation	UDP-D-galactose(2-)
Peak:m/z	Relative Intensity
175.2294312	0.05
192.9279175	0.08
196.9071960	0.02
211.0632172	2.24
212.1555176	0.14
241.0975952	0.94
242.1376648	0.04
255.1169128	0.03
262.0141602	0.01
272.9051514	0.10
279.9954224	0.92
281.0957031	0.06
293.0046997	0.08
295.0386353	0.03
302.8939209	0.01
305.1487427	0.11
306.1884155	0.01
321.1059570	0.38
323.1119995	100.00
324.1136475	8.56
360.2038574	0.05
385.1343994	1.83
386.1060791	0.21
390.9108887	1.80
391.9619751	0.11
403.0931396	2.79
404.1259155	0.36
410.9213867	0.13
428.8452148	0.61
429.8172607	0.24
430.8235474	1.60
445.4629517	0.12
467.2263794	0.35
470.6433716	0.01
482.7439575	1.01
520.0970459	0.15
522.6516113	0.01
547.1563110	0.45
548.3088989	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	353.0875
Annotation	Chlorogenic Acid
Peak:m/z	Relative Intensity
105.9856644	0.02
108.2355957	0.02
109.0184402	0.11
116.9873428	0.03
127.0200653	0.09
129.2533722	0.03
132.9878082	0.12
134.0105896	0.48
134.9987183	5.93
136.0597229	0.87
136.9431152	0.06
144.6664734	0.06
147.2447662	0.09
155.0411987	0.20
156.1322327	0.04
160.9964905	0.70
161.9676361	0.30
164.0062561	0.03
169.7088013	0.05
171.1007385	0.05
173.0529785	2.42
174.0830078	0.32
175.1667328	0.71
176.0284424	0.23
179.0123291	40.96
180.040802	8.46
180.646225	0.03
189.0218506	0.55
191.0572205	100.00
192.0969543	16.30
219.0585938	1.52
219.9118347	0.48
233.0717468	1.73
234.0735168	0.59
253.8829956	0.03
261.2090149	0.10
262.9267273	0.06
266.2271423	0.04
272.4420776	0.07
274.0545044	0.01
276.0957031	0.02
281.3825073	0.11
291.1294861	0.03
308.2774353	0.18
309.182373	0.03
310.1322632	0.06
310.7678528	0.04
325.1591797	0.22
325.8747253	0.04
335.0571899	0.25
336.2604675	0.62
337.4258118	0.02
338.2211609	0.04
339.8262329	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	306.0764
Annotation	Glutathione
Peak:m/z	Relative Intensity
92.9682159	0.05
96.8907623	0.05
99.0951538	0.17
116.0148468	0.22
124.0903244	0.19
125.8635559	0.11
128.0462036	10.37
130.1885376	0.32
143.0701599	8.27
145.2635193	0.50
146.0584412	0.74
157.0510406	0.14
159.9895477	9.84
166.3860321	0.24
167.1872101	0.32
169.1423035	0.21
170.0171204	0.14
171.0962830	0.92
176.0611877	0.08
177.0962524	7.56
179.0358582	7.37
181.3641205	0.07
185.0774384	0.53
187.8854218	0.21
189.9938354	0.04
197.1906586	0.85
201.2273254	0.22
202.0903625	0.30
203.0739136	0.17
205.0516663	0.05
210.1338196	5.08
213.0319519	2.50
221.1640625	0.12
225.3035278	0.18
227.0179138	0.36
228.1882629	1.08
230.9960938	1.15
232.2387085	0.18
233.2704773	0.04
236.1374512	0.39
236.8319702	0.14
242.1934204	2.38
243.3094482	0.07
246.0846558	0.85
254.0785828	88.74
254.7272949	0.19
259.1651917	0.49
260.1835327	0.12
262.1316528	2.16
268.1667480	0.05
269.2499695	0.43
270.0761108	0.18
272.0921631	100.00
282.3445129	0.13
288.0097351	60.52
289.2243042	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	358.0269
Annotation	Sinigrin
Peak:m/z	Relative Intensity
105.7678070	1.22
113.1406403	0.66
115.9563522	3.83
118.8462524	3.56
119.7241745	0.54
122.9958801	0.49
128.8562012	1.24
130.7839966	0.46
133.0087585	0.68
134.8684998	6.04
138.9172974	1.24
140.9542847	0.35
143.0075226	0.95
144.9577942	5.04
155.9956665	0.47
161.9890137	44.90
163.0762329	5.82
164.8298950	0.39
167.0018158	0.65
177.1388397	0.35
180.0474548	11.31
192.9081116	0.18
194.1041870	0.74
195.0636902	9.24
195.9900970	4.53
199.1686707	1.10
224.3230896	0.83
227.0691528	4.25
235.1542664	0.28
238.6418762	0.44
240.8949890	4.26
257.0761719	0.20
259.1009216	100.00
274.0783386	1.94
275.0979004	36.88
276.3182068	0.18
278.0817261	13.45
279.0848389	0.93
295.1390686	0.29
297.2597046	0.25
310.8059387	0.85
311.4105835	0.78
323.6551819	0.71
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	531.1695
Annotation	Pikuroside
Peak:m/z	Relative Intensity
163.9764099	0.12
174.9662781	7.81
192.1181488	0.13
193.2621613	0.04
207.1131592	42.55
217.2548523	0.04
219.1417847	0.31
220.9024963	0.07
225.0605164	1.54
235.0756531	0.59
243.1054230	0.04
245.1902618	0.22
247.0335999	0.13
261.1042480	0.03
263.0204163	0.22
271.1416931	0.11
275.0423584	0.08
287.0828857	0.09
291.1853943	1.53
303.1398926	0.35
305.3110657	0.19
315.0704346	0.26
321.2514648	0.50
333.0815430	1.04
351.0523682	38.85
369.0923462	100.00
386.9779053	0.05
424.2925415	0.06
481.5819702	0.09
495.3207397	0.27
505.3207397	0.17
512.8505249	0.34
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	447.0531
Annotation	Glucobrassicin
Peak:m/z	Relative Intensity
128.9456635	0.28
131.7390442	0.29
138.8842163	3.05
144.2790833	1.50
144.9399567	2.16
156.0376892	0.22
163.0245056	1.48
164.1580505	0.18
168.9418182	1.47
171.0910187	0.78
171.9814453	5.48
172.9877472	1.08
173.9530487	0.37
187.0302429	1.43
188.9618530	1.18
190.2033691	1.09
192.9954834	0.17
194.9763794	3.69
199.2155151	0.30
199.9892578	0.40
203.0854340	1.25
205.0046082	19.10
205.9513092	3.86
207.2711487	1.31
224.1185913	1.04
226.9931946	4.81
228.2037659	0.45
234.1860657	0.70
241.1198425	4.53
242.9769287	1.72
251.0537720	6.99
252.1260376	0.47
254.1263733	5.62
255.0681152	0.97
256.0109863	0.68
259.0824280	100.00
260.1233826	10.77
269.1089783	21.17
269.9319458	2.28
275.0218201	29.23
276.0783691	7.24
277.0471802	0.27
285.1696777	0.53
291.0738831	31.16
292.1675415	1.81
297.8092651	0.47
298.4400024	0.60
367.0911560	13.90
368.0916748	3.72
385.9143372	0.59
402.8340149	0.84
411.6009827	0.30
413.1680298	0.42
416.2986145	0.56
417.1432495	0.43
429.3904114	0.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	746.1777
Annotation	Unknow
Peak:m/z	Relative Intensity
225.9043579	0.32
234.2716217	0.50
298.0299377	0.48
300.1435242	0.18
313.2929688	1.28
315.9639587	1.27
331.2683105	5.24
332.3814697	1.08
365.1783447	0.44
389.7711182	1.32
396.9205322	0.51
398.8317261	2.03
408.3792725	1.04
430.7501221	0.73
438.3659668	0.48
445.6031494	0.31
465.9979248	0.48
466.6195068	0.29
523.3356934	1.73
530.2929688	0.54
594.0791626	1.34
597.4084473	0.46
612.6100464	0.30
613.2633667	0.71
630.3909912	1.47
631.5588989	1.00
632.4006958	1.66
650.5695801	0.48
678.4434204	0.36
682.8264771	0.44
695.9838257	1.53
697.5784912	0.22
699.0416870	0.48
702.7880249	0.18
704.0877686	0.75
710.7440796	0.71
714.6621704	1.78
716.9320068	3.12
718.3168335	0.34
721.0836792	1.63
722.2283325	1.05
726.0409546	1.97
727.8110352	1.40
728.4141235	1.03
729.0818481	0.18
729.7295532	0.26
730.3469849	0.24
732.4221802	0.38
733.0713501	1.55
734.4420776	8.57
753.6481934	2.61
757.8323975	0.61
764.2568359	0.25
765.5884399	0.42
766.9376831	0.38
768.7333374	0.71
769.7060547	0.30
771.1505737	3.24
775.5403442	8.30
777.7083740	1.03
778.7582397	4.14
780.1921997	0.26
806.8150024	1.56
814.4364624	0.48
815.4996948	0.82
816.9987793	3.69
818.7203369	1.45
821.1150513	1.62
825.8568726	3.58
832.4146118	2.93
834.5198364	2.20
835.2300415	2.62
841.4953613	13.58
845.8384399	100.00
846.6106567	10.67
847.6484375	1.81
848.8302612	1.33
850.0453491	1.69
851.1101685	1.97
865.2853394	0.76
868.3890991	0.72
878.1569214	2.46
880.0485229	1.21
883.0512695	1.02
887.0124512	0.87
895.7937012	0.14
897.5590210	1.05
911.5691528	1.15
912.3884888	0.28
934.1633301	2.46
936.1450806	1.05
938.5057983	3.97
958.1164551	0.42
959.9534302	1.17
966.3467407	12.80
966.9898071	3.49
972.4511719	42.26
973.2416992	6.35
981.8159790	0.38
992.7736206	2.01
1004.5971680	2.08
1021.4553830	0.91
1027.2497560	2.89
1031.5532230	0.42
1033.6671140	16.06
1034.5372310	4.71
1044.7651370	0.85
1067.5192870	1.86
1086.2625730	0.32
1088.9138180	0.52
1120.3742680	1.29
1127.6406250	2.49
1152.9238280	0.52
1172.1015620	0.61
1233.5144040	0.79
1249.9116210	0.71
1270.7285160	2.04
1278.2097170	1.33
1302.5024410	0.54
1423.8039550	0.51
1471.5625000	0.32
1515.7413330	0.85
1590.0728760	0.82
1623.9266360	0.40
1693.2152100	0.50
1805.7740480	0.48
1876.7003170	0.22
1880.4758300	0.57
1903.1721190	0.28
1911.9244380	18.55
1927.8602290	0.40
1930.3249510	2.41
1943.8106690	0.18
1962.2073970	1.80
1969.9810790	0.68
1975.0897220	36.62
1976.1021730	0.26
1978.5599370	0.36
1980.3210450	0.22
1989.9815670	0.35
1990.7928470	2.75
1994.7010500	0.44
1998.1195070	0.76
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0855
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
78.98392487	0.07
91.05307007	0.09
95.15270233	0.08
103.0513306	0.05
104.1385193	0.21
104.8050537	0.32
107.0969391	0.07
109.0027313	0.33
109.8491364	0.23
122.8140411	0.13
128.2866058	0.20
128.9231567	0.45
134.1073303	0.11
138.0753784	0.26
140.9728394	0.27
141.953186	0.09
144.0438232	0.37
145.99263	0.84
150.9467621	8.56
151.9137573	1.15
153.0425262	0.26
155.1678314	0.20
158.0392609	0.23
160.2271271	0.12
161.1981354	0.17
162.0772705	0.45
166.0071259	0.31
167.0277863	0.46
168.9879456	0.20
170.0837097	0.52
171.0760651	0.15
171.985611	0.28
177.2723694	0.07
178.4230957	0.26
179.045639	0.14
180.0563812	0.19
181.1902771	0.09
182.2373352	0.06
183.0645752	0.48
185.2911835	0.24
186.1657562	0.07
188.0142212	0.07
189.0775452	0.23
192.9489899	0.21
195.0037842	0.11
197.07547	0.61
198.0361481	0.69
199.8014069	0.19
206.0709381	5.83
206.9550323	0.37
208.0246124	0.60
209.0836945	0.23
210.0587006	0.16
210.9570312	0.31
212.1024323	0.17
213.0323944	0.27
217.2114716	0.63
218.0853577	2.83
219.0148163	0.08
225.0963898	2.35
226.2168121	1.30
232.9290619	0.13
235.4081573	3.16
236.148819	7.85
237.0489044	0.31
238.2119904	2.84
239.085495	1.50
240.3283234	0.18
251.2717133	0.05
253.0913086	100.00
254.1412811	3.68
255.2992096	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	334.16
Annotation	PEFLOXACINE
Peak:m/z	Relative Intensity
112.763855	0.13
115.1062012	0.13
118.1979065	0.30
120.0142059	0.88
121.1637421	0.20
127.1244354	1.19
153.0655518	0.78
161.8714142	0.43
163.0705719	0.29
166.1141663	1.16
183.0977478	0.25
223.0002747	0.48
225.2634277	0.29
226.9031372	0.46
230.8967285	0.65
235.6246948	0.24
238.3838501	0.20
249.3203125	0.13
262.9783936	0.78
268.0208435	0.50
270.142395	0.79
271.0201111	0.39
284.9663391	3.35
286.4786377	1.32
288.2012939	87.76
289.0789795	1.06
290.2073975	0.17
291.0144043	0.18
292.0877686	0.16
298.0435791	0.69
299.2240295	1.13
302.295166	0.59
303.3359375	0.42
310.7113037	0.37
316.1412354	100.00
319.3530273	0.55
327.1737061	0.40
341.7344971	0.42
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	449.0757
Annotation	Trichodermamide B
Peak:m/z	Relative Intensity
151.0563965	0.10
159.1898041	0.10
161.0952606	0.03
167.1332855	0.01
169.1698914	0.09
171.2674255	0.02
182.8978119	0.05
195.0940552	0.03
196.8847351	0.05
213.1514282	0.11
225.2281189	0.05
237.1761475	0.05
240.9630737	0.62
243.6716003	0.05
244.9118958	0.13
245.9477539	0.02
253.3829956	0.03
256.9944153	0.36
262.6580505	0.02
269.6015625	0.03
277.0188293	0.05
279.0482483	0.07
280.4535217	0.13
281.5678101	0.05
283.1401978	0.02
285.2866821	0.05
286.2073975	0.08
287.3980103	0.15
288.5022583	0.02
291.9433594	0.08
299.2978516	0.03
303.2725220	0.04
313.1129456	0.12
318.4016113	0.03
326.9935913	0.04
331.0421448	0.15
335.0112305	0.04
342.7385559	0.07
347.4396057	0.13
353.1762085	0.09
357.4475403	0.11
358.3542786	0.04
363.1812134	54.80
367.4415894	0.08
368.5228577	0.04
371.4306335	0.06
378.0614014	0.04
384.3865051	0.04
385.2786560	0.09
386.6295776	0.03
387.4243774	0.17
389.4510193	0.10
391.3509216	0.04
393.1193542	0.07
402.4546204	0.06
403.6572571	0.12
405.1253052	100.00
407.4772949	0.05
410.8052063	0.03
412.0326233	0.32
412.7730713	0.04
413.4173889	0.16
417.3253784	0.02
419.3034363	0.08
421.2463074	0.22
429.5088196	0.10
431.1556091	4.28
432.0555420	0.10
441.0386047	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	562.3147
Annotation	Unknow
Peak:m/z	Relative Intensity
171.2434540	0.01
172.1379395	0.02
223.9799500	0.02
242.2767639	0.02
255.2725372	0.05
260.0847473	0.00
277.3012085	0.37
278.1483154	0.03
284.2940674	0.00
293.2294312	0.01
307.3155518	0.01
309.3552246	0.02
344.4716797	0.01
365.5871582	0.01
369.0529175	0.01
382.5499268	0.03
389.4755859	0.01
391.5471802	0.02
400.2255249	0.00
409.4521484	0.04
413.3828125	0.11
414.3614502	0.01
419.5921631	0.02
431.4578857	0.01
443.3678589	0.02
448.1058960	0.01
459.7031250	0.01
466.5600586	0.02
475.5562744	0.01
476.6206055	0.01
477.7028198	0.01
478.5552368	0.02
483.5460815	0.01
491.4140015	0.02
502.3687744	100.00
503.4788208	0.94
504.6897583	0.00
516.1525269	0.04
519.9785767	0.01
520.6520386	0.04
523.5687866	0.01
526.3190918	0.04
528.2922363	0.02
531.3527222	0.01
540.9518433	0.01
544.3067017	0.02
545.5548706	0.06
548.2429810	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	383.1194
Annotation	Acetyl-maltose
Peak:m/z	Relative Intensity
170.8961792	0.20
173.0617981	0.48
175.1259155	0.22
191.0955200	100.00
203.1520386	0.19
207.0280151	1.85
209.1748505	0.46
219.0443420	0.18
219.9991455	0.32
233.1729431	0.05
241.8659363	0.06
247.2095947	0.14
263.1865540	0.25
267.3238831	0.24
267.9550171	0.40
275.9694519	0.12
285.1419983	0.09
291.9993286	0.19
293.1377563	1.18
295.1378784	0.09
296.2218628	0.06
303.1248169	0.07
311.1314087	0.07
317.2774048	0.35
321.4049683	0.15
323.1668701	0.38
335.4223022	0.06
337.3345337	0.12
339.4910278	0.15
340.4948120	0.59
344.5526123	0.17
364.6984253	0.60
365.3139038	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	459.2148
Annotation	Unknow
Peak:m/z	Relative Intensity
153.1813965	0.04
165.1315155	1.30
166.9308167	0.17
184.9542847	1.59
191.1017761	0.07
197.3491821	0.03
204.7573242	0.03
212.8926849	0.10
215.3914185	0.05
223.1388092	0.06
231.1379852	0.06
247.2211914	1.14
269.0905151	0.05
273.2254639	4.59
274.1118469	0.02
285.2727356	0.14
291.2421875	100.00
303.2124329	0.07
323.5605774	0.17
332.0373230	0.03
336.1439209	0.03
339.2356262	0.05
341.1234741	0.05
349.2105103	0.04
351.0046387	0.06
357.1536865	0.06
358.9596558	0.16
361.0031433	0.07
368.8528442	0.20
369.5875854	0.04
371.5121155	0.06
373.2454834	0.09
381.4620361	0.05
385.1198425	0.05
386.6788025	0.11
391.2078857	0.07
398.6362610	0.06
402.9815369	0.06
404.3515625	0.07
411.0805664	0.04
413.1433105	0.94
414.1046448	0.07
415.3834534	0.38
417.2106323	0.04
418.4716492	0.05
420.8061829	0.28
422.3865051	0.43
423.1567078	0.10
423.8236694	0.07
425.5893860	0.04
431.0550537	0.22
436.6326599	0.16
440.3749695	0.09
441.3100891	0.40
442.1756287	0.11
461.2617493	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	334.1642
Annotation	PEFLOXACINE
Peak:m/z	Relative Intensity
96.95355225	0.21
120.0895081	0.46
120.8638916	0.45
123.0189667	0.39
127.2249603	0.42
141.2043457	0.23
145.2120819	0.46
149.9676514	0.60
151.0381165	1.13
156.7626648	0.71
163.9747162	0.34
166.0992432	1.91
168.1696625	0.65
169.0041656	1.06
179.1017151	0.46
187.0688171	0.35
199.0538788	0.26
209.1069946	0.29
211.4408569	0.72
213.0860291	0.31
214.9970093	0.35
228.8098755	0.44
230.9043274	0.78
235.2112122	0.45
242.1237488	1.34
244.3146667	0.86
249.8964233	1.36
252.5759888	0.41
262.345459	0.78
262.9873657	0.74
270.2199402	1.71
271.0532837	0.47
274.4826965	0.36
284.9543762	5.51
288.2069092	88.77
288.9985352	1.06
290.1795654	0.45
291.0391235	0.31
293.1097412	1.07
298.7290344	4.19
302.90979	0.49
304.2666626	0.66
306.8815918	0.31
310.2052002	0.40
316.1436462	100.00
317.1864929	2.11
319.0459595	0.45
320.1788025	0.32
324.809082	1.35
333.7463989	1.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	262.0721
Annotation	4-Hydroxyphenylacetylglutamine
Peak:m/z	Relative Intensity
96.9518585	0.05
98.9548035	0.92
108.7369995	0.05
118.0022736	0.55
164.0084229	1.24
174.1866608	0.60
176.0642242	0.21
179.0074615	0.11
180.1613312	0.05
184.1548309	0.20
194.1737823	0.48
199.5131226	0.11
200.1243439	0.33
201.0724335	0.19
202.1285858	0.11
215.9620361	0.14
218.0852661	3.57
225.1869202	0.23
226.0208282	0.16
232.2577057	0.07
244.0578156	100.00
244.8740845	0.05
246.2374878	0.06
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
82.84544373	0.07
86.70056152	0.01
87.86196899	0.04
94.97128296	0.14
103.1097565	0.07
105.1175232	0.22
106.500061	0.06
107.1225281	0.04
108.9907837	0.09
122.8484955	0.04
125.8249817	0.04
127.8416138	0.04
128.9113312	0.74
130.0278625	0.15
136.9655457	0.02
138.099823	0.03
141.2485809	0.10
145.0635376	0.07
145.8309479	0.04
146.8697968	0.10
148.2397766	0.02
150.9826813	10.15
151.9779205	1.64
153.0433502	0.08
154.2854919	0.06
155.0788574	0.11
157.0784302	0.08
162.183609	0.01
165.1308136	0.05
166.1377869	0.08
167.1534119	0.11
168.043869	0.14
169.0937042	0.23
170.2454681	0.18
171.0997314	0.02
175.114975	0.06
178.0571136	0.01
179.1220551	0.19
180.0883636	0.08
181.2001495	0.13
182.2325592	0.10
183.1036682	0.31
185.017868	0.48
186.3142548	0.07
190.2523499	0.03
194.1100769	0.19
197.0281219	0.78
198.0658112	0.17
206.0751953	0.05
207.1909637	0.19
208.083847	0.15
209.151535	0.12
210.125351	0.07
210.8012848	0.10
212.2334595	0.05
217.3434906	0.02
218.2504425	0.02
225.1039886	1.32
226.2086639	0.40
235.250351	0.28
236.1531372	0.53
238.0688019	1.82
239.1145477	0.48
240.3505707	0.02
251.1027222	0.11
253.0900726	100.00
254.1587067	2.13
255.1373901	0.29
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	327.0027
Annotation	Unknow
Peak:m/z	Relative Intensity
96.8603134	0.83
100.9879608	0.08
103.1206131	0.05
135.0191803	0.11
145.0964355	0.21
158.0221710	0.12
162.9136047	0.08
167.1425476	0.28
170.9806976	0.05
172.9576416	0.11
185.4017181	0.11
191.0873108	0.12
195.0070496	0.58
204.9818115	0.08
207.0865631	0.23
208.0723267	0.39
214.7837830	0.11
220.8209229	0.09
222.8950806	0.09
225.3040466	0.06
231.2109375	0.04
234.7479858	0.10
239.1434326	1.22
241.1377258	25.64
247.0694580	0.22
249.1814575	0.04
253.1757202	0.10
255.3164368	0.15
262.2044067	0.28
264.9699707	0.26
265.9229736	0.08
267.0618286	0.18
268.1752625	0.07
281.0877075	1.58
283.0512085	100.00
289.0231628	0.05
297.0323181	0.30
309.0399170	6.82
312.3544312	0.88
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	465.0706
Annotation	Unknow
Peak:m/z	Relative Intensity
137.0556793	0.03
167.0335388	0.07
177.9666138	0.05
219.1430817	0.03
221.2247925	0.06
241.1092224	0.38
252.9240723	0.03
254.0848389	0.03
259.0753174	0.03
267.2875061	0.02
272.3188782	0.05
278.4853516	0.12
283.1272278	3.25
289.0975647	0.03
293.1099243	0.03
303.3483887	0.26
327.1662598	2.42
332.4192200	0.05
345.3593750	0.05
357.3417969	0.05
361.2233887	0.45
369.0300903	0.18
377.2830505	0.61
379.1403503	44.61
379.7678528	0.07
388.3110657	0.05
400.9885559	0.10
403.3270569	0.02
404.2409668	0.05
405.4026794	0.13
417.1365051	0.17
419.2915649	0.30
421.1419067	100.00
421.7616272	0.29
423.0122070	0.08
427.2980042	0.17
429.0693970	0.07
434.3897705	0.03
444.7455444	0.10
447.1127625	4.35
448.0104065	0.06
455.8065491	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	331.1639
Annotation	Quinocarcin
Peak:m/z	Relative Intensity
119.9789429	4.93
148.9353333	2.34
166.0226746	100.00
183.1401520	0.97
224.3551636	0.22
252.9513550	0.24
254.9582214	0.75
267.0476074	0.62
313.3730774	1.99
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1222.44
Annotation	Unknow
Peak:m/z	Relative Intensity
364.2539673	0.24
369.9720459	0.55
374.1300964	0.77
392.3381348	0.17
430.5043945	0.42
438.4816284	0.61
444.1821289	0.51
450.4173279	0.47
456.3831787	0.66
497.3906250	0.27
499.1226501	0.91
503.0719299	2.29
504.1007996	0.93
509.4252319	0.27
515.4341431	0.56
520.3231201	0.31
522.9435425	0.33
528.5222168	0.09
530.3333130	0.35
537.5974731	0.82
539.2241211	0.39
541.0279541	0.12
546.6184082	0.07
547.4584351	0.15
554.8236084	0.55
557.2984619	0.29
558.3147583	0.51
569.4203491	0.63
572.3464355	0.34
573.6974487	0.09
577.4420166	0.67
583.7128906	0.40
586.5074463	1.08
587.5223389	0.17
595.7055664	0.65
605.2404785	0.80
616.3653564	0.45
617.6513672	0.29
630.7547607	1.16
631.5198975	0.32
633.3680420	0.22
634.2520142	0.54
635.5314941	1.16
641.5544434	0.38
644.1547852	3.70
644.9802246	0.25
648.4520264	0.45
649.2929077	0.36
652.3454590	0.22
653.4211426	0.43
655.4376221	0.35
666.4840088	0.18
673.4659424	0.96
674.6070557	0.25
676.1757812	1.98
677.1184082	1.25
678.1876831	1.64
685.8897705	2.05
687.6392212	0.20
691.4393311	0.45
703.4771118	0.22
713.1063843	0.48
716.7089844	0.49
719.7119751	0.37
721.3952637	0.29
722.7003174	0.35
725.2473755	0.11
726.4371948	1.99
727.6823730	0.81
728.6390991	0.34
729.5021362	0.29
734.1635742	0.95
734.8115234	0.58
736.4630127	0.17
737.3183594	0.36
742.7342529	1.68
743.8124390	2.63
744.5396729	5.02
745.4732056	1.15
746.4612427	0.71
753.3908691	0.24
754.6790161	0.24
756.9366455	0.37
765.6964111	0.38
766.4702148	0.33
774.3123169	3.00
779.2319336	0.15
781.4986572	1.00
784.6035156	0.98
785.2808838	1.55
788.4099121	0.80
789.2399902	1.40
790.7034912	0.47
796.6425171	1.15
798.1859131	0.93
799.5557861	0.20
804.3504639	0.43
809.8056641	0.25
812.6110840	0.17
815.3824463	0.32
819.6116333	0.93
829.4400635	1.16
831.8717041	0.13
834.9918213	0.28
835.7102051	1.26
836.5256348	0.69
837.4592285	3.85
838.6557617	1.85
839.9129639	1.14
842.2058105	5.09
843.5334473	1.97
849.4362793	0.60
851.6043701	0.48
859.8322754	1.10
861.8483887	0.52
869.5111084	0.77
873.5712891	0.20
874.2723389	0.29
875.4368896	0.60
876.6295166	0.35
877.7978516	1.11
883.4663086	1.14
884.1234131	0.97
889.4171143	2.94
890.4259033	0.28
891.4190674	0.14
894.6218262	0.29
898.8355713	0.36
900.3605957	2.32
901.4573975	0.53
903.4816895	0.40
907.4235840	1.37
908.1077881	0.27
909.5612793	0.70
913.6729736	2.31
914.6010742	3.17
915.4588623	1.41
916.1074219	0.76
917.3620605	0.42
919.6429443	0.40
920.5611572	0.27
921.2739258	0.31
927.2452393	0.75
928.4202881	1.09
932.1743164	1.14
933.2653809	0.28
934.9570312	0.15
935.5760498	0.49
940.5698242	0.84
943.6522217	0.59
944.4146729	0.22
946.2673340	0.16
948.8916016	0.13
952.1308594	7.69
952.9146729	1.48
954.6370850	0.70
959.1314697	0.82
960.8348389	1.96
967.3640137	0.27
969.3270264	0.37
972.6408691	1.08
974.5800781	0.28
979.0473633	1.23
980.2333984	0.64
981.1954346	0.99
983.7243652	0.29
986.2404785	0.54
987.0179443	0.76
987.7440186	2.34
988.6274414	0.62
989.7802734	22.70
990.8010254	4.35
991.6610107	0.27
998.4423828	1.93
1003.5794680	0.17
1006.6051030	1.62
1009.1767580	0.15
1013.6979980	0.64
1015.4267580	1.19
1016.8310550	1.43
1020.3394780	0.76
1021.8233640	3.09
1024.0773930	0.53
1025.2644040	1.95
1029.3425290	1.32
1029.9760740	0.21
1031.4892580	1.51
1033.5380860	0.84
1035.6193850	2.03
1037.8509520	0.49
1040.2167970	0.14
1040.8457030	0.20
1044.9012450	1.89
1045.5903320	0.74
1046.6856690	0.32
1047.3083500	0.36
1052.4609380	0.32
1055.7102050	4.86
1056.8504640	0.93
1062.7723390	0.20
1067.6210940	4.32
1070.2385250	0.56
1071.4189450	1.74
1072.7333980	0.29
1074.5966800	3.28
1075.7504880	1.19
1076.6164550	1.93
1078.6237790	0.48
1079.8123780	2.36
1089.5896000	1.55
1090.2150880	1.40
1091.3914790	0.28
1092.0805660	0.86
1092.7100830	2.30
1093.7323000	1.06
1094.5783690	2.01
1096.4052730	1.02
1098.4396970	0.63
1101.4213870	1.74
1102.6260990	0.85
1103.7116700	1.96
1104.4246830	0.60
1105.7983400	0.34
1106.9055180	1.03
1109.5500490	0.38
1110.7967530	0.18
1112.0891110	5.03
1113.1735840	5.06
1114.5986330	0.76
1117.9802250	2.89
1119.7675780	1.38
1120.8869630	2.17
1123.0051270	4.77
1123.8328860	0.71
1130.8161620	2.48
1131.9484860	3.82
1137.5302730	0.52
1138.6462400	0.54
1140.2692870	0.57
1141.7795410	7.38
1143.0544430	0.69
1144.0285640	0.28
1144.9108890	0.41
1146.3559570	2.58
1147.3752440	4.96
1148.3562010	0.83
1149.9626460	2.45
1151.3302000	1.48
1152.5289310	0.15
1153.8532710	3.86
1154.7186280	0.65
1156.2874760	4.74
1158.7131350	1.62
1159.9198000	2.75
1160.7111820	4.29
1162.0516360	0.60
1162.6562500	0.19
1163.5136720	2.79
1166.6179200	44.27
1167.9689940	2.97
1169.0063480	0.90
1169.8811040	4.48
1171.4035640	1.85
1172.7570800	5.19
1173.7193600	0.44
1175.4638670	11.74
1176.4096680	0.38
1177.2032470	10.01
1178.5388180	56.09
1179.5240480	0.39
1180.5253910	0.82
1181.1909180	0.70
1182.1679690	0.43
1183.2871090	1.46
1184.3491210	0.20
1185.4260250	2.27
1189.4013670	0.30
1190.5198970	1.57
1191.5784910	0.42
1192.4781490	1.95
1194.6142580	3.45
1195.8137210	0.59
1196.5266110	1.19
1197.4964600	0.57
1199.3959960	3.28
1200.1455080	4.72
1200.8146970	14.29
1201.5734860	4.43
1203.2318120	51.61
1204.0625000	6.39
1205.7906490	100.00
1206.6594240	5.40
1207.6330570	6.43
1208.5449220	21.84
1209.5639650	0.66
1210.6092530	0.99
1212.0654300	0.73
1215.0617680	0.29
1217.6484380	0.22
1222.3300780	1.41
1224.6054690	0.30
1226.1206050	0.64
1227.0407710	0.51
1229.1057130	0.13
1230.6550290	3.08
1231.5631100	1.85
1234.0755620	0.50
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
92.9347076	4.15
135.8279419	0.17
136.9157410	100.00
143.0957947	0.07
178.1285706	0.07
179.3079529	0.19
180.2640533	0.07
201.4155579	0.14
209.1518860	0.22
219.0522461	0.21
221.0482788	0.13
225.1622925	0.07
237.1119385	0.09
238.8833008	0.04
252.9786377	0.35
254.3066711	0.27
255.0647583	0.23
256.3430481	0.04
267.1454468	0.04
269.4650879	0.16
271.4390869	0.06
278.0676270	0.19
281.0818481	0.63
282.8957520	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.0712
Annotation	Deoxyinosine
Peak:m/z	Relative Intensity
97.10295868	0.33
138.0735016	0.15
145.8974457	0.71
148.8499908	0.69
167.0406799	0.58
179.0547333	0.47
181.2083893	0.95
183.2508698	0.57
193.2112122	1.40
195.3714752	0.65
206.526535	3.22
207.1479187	9.66
208.0350952	4.21
209.1135101	2.87
210.2253876	0.43
214.9799347	0.41
222.2694397	8.91
223.1959686	6.83
224.1459198	1.06
233.4182739	0.24
251.0839081	100.00
252.1303864	13.84
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	737.2269
Annotation	Helonioside B
Peak:m/z	Relative Intensity
207.0543823	9.18
217.1514587	0.05
219.0066986	0.46
221.0815277	0.17
222.2284546	0.05
224.6852570	0.04
225.3246918	0.22
226.0830383	0.03
233.0004730	0.05
235.0455933	0.06
239.1354370	0.03
242.4793701	0.13
244.9165955	0.13
247.1132355	0.03
248.7639465	0.05
255.1356659	0.12
256.0913086	0.08
257.4349670	0.05
258.1072388	0.05
260.9592896	0.21
263.0806580	0.07
273.1921692	0.07
277.0690918	0.09
285.1315308	0.13
291.1409912	1.01
300.1423950	0.07
303.1921997	0.12
314.9872131	0.72
321.3495483	0.22
333.1647339	0.63
342.9718018	0.05
351.1255493	9.52
355.1343384	0.06
363.2429199	0.06
367.3106689	0.31
369.0437622	100.00
371.5427246	0.02
372.7905273	0.04
381.2215576	0.05
385.4440918	0.04
386.2205200	0.07
387.0475464	0.04
397.3139038	0.15
403.3566895	0.06
421.2543945	0.16
426.8783569	0.10
428.6443481	0.05
436.5396118	0.15
439.3854980	0.11
477.4351196	0.05
508.6890259	0.05
509.4150391	0.04
516.8397827	0.07
521.1077271	0.21
539.3382568	0.28
540.2658691	0.02
547.4028931	0.45
557.5496216	0.14
565.2590942	0.50
574.6041870	1.52
575.2878418	1.57
577.3894653	0.12
583.2455444	0.76
586.5610962	0.05
649.6317749	0.04
653.5346680	0.08
656.2751465	0.05
700.1045532	0.11
701.0120239	0.47
705.2624512	0.04
718.2456665	0.28
719.0421143	0.68
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	904.83
Annotation	Unknow
Peak:m/z	Relative Intensity
326.4438477	0.07
383.9495239	0.10
399.9714355	0.08
439.5216064	0.11
440.2186279	0.10
491.9968262	0.16
507.8109741	0.15
531.2647705	0.19
536.6574707	0.25
580.6685181	0.09
582.1406860	0.31
589.3898315	0.28
614.5455322	0.33
620.4700317	0.12
635.1404419	0.29
638.3881226	0.35
656.0916748	0.08
672.6145630	0.05
678.6488037	0.12
710.2890015	0.18
724.5585327	0.12
735.6953735	0.05
736.6837769	0.43
778.7728882	0.06
785.5211182	0.08
800.5922241	0.49
808.9927368	0.08
809.9743652	0.05
812.0607910	0.28
821.4948120	0.22
830.4151611	0.16
835.7080688	0.21
840.4031372	0.53
843.0770874	0.11
850.1873169	0.34
856.2041626	0.10
857.7527466	0.22
859.1972656	1.16
860.9406128	0.41
867.0300903	0.39
867.8352661	0.06
877.6450806	0.59
880.6195068	3.14
881.4007568	1.43
882.9118652	1.84
883.5700684	0.04
884.3004761	0.21
885.2434692	0.21
886.3619995	1.03
888.2775269	0.14
890.9019165	1.55
891.9213257	3.39
892.5214233	1.90
893.4091187	0.97
894.8789062	0.70
895.9801025	0.13
896.5848999	0.10
901.6369019	0.24
906.8867798	0.23
928.6684570	0.32
932.2333984	0.16
946.2490845	0.11
949.4362183	0.08
951.6721802	0.52
954.0988770	0.30
955.6257324	0.27
963.4744263	0.33
964.3348999	0.20
965.2639771	0.34
966.0400391	0.58
966.8947754	0.54
972.5632324	1.02
973.2085571	0.95
976.1793823	0.22
979.7519531	2.28
983.3871460	0.08
987.4688110	0.81
988.1935425	0.06
991.4750977	1.19
992.4129028	0.71
994.5437012	1.45
995.3563843	0.52
996.5312500	0.56
998.0927734	0.13
999.1494751	0.06
999.7804565	3.29
1001.0674440	1.25
1001.6791380	0.06
1003.3613890	2.60
1004.3825680	0.22
1005.3745730	1.00
1006.7067870	2.30
1007.3878780	0.96
1008.6635130	3.40
1010.5751950	0.35
1011.4119260	15.18
1012.7534180	1.52
1013.3789060	3.85
1014.1130370	0.25
1016.1425780	51.98
1017.2395630	1.95
1018.1820680	3.19
1018.9176640	0.44
1020.5399780	2.09
1021.6901860	2.38
1023.0928340	4.47
1023.9280400	0.74
1025.0607910	4.22
1025.9125980	2.85
1027.4809570	30.52
1028.1876220	7.61
1029.3487550	1.34
1030.6423340	100.00
1031.8500980	3.83
1032.7899170	9.04
1033.6735840	9.58
1035.3508300	2.46
1036.3984380	2.62
1037.7564700	0.46
1038.5164790	0.07
1039.4820560	0.08
1040.5910640	0.14
1041.5612790	0.86
1042.6816410	0.34
1044.3206790	0.94
1045.1311040	0.12
1046.5219730	0.25
1047.3818360	0.51
1049.4956050	0.73
1050.3659670	0.08
1053.6246340	0.24
1054.8687740	0.15
1058.4394530	0.07
1062.4766850	2.96
1071.4334720	1.83
1072.1130370	0.12
1075.5743410	0.81
1078.2547610	0.17
1080.3851320	0.98
1083.4396970	1.33
1086.9172360	0.61
1090.7387700	0.65
1094.4147950	0.20
1097.5645750	0.95
1106.6036380	0.59
1108.4570310	0.76
1109.4838870	0.28
1112.0966800	1.36
1117.0769040	0.63
1121.8769530	0.83
1123.7340090	0.78
1124.5653080	0.17
1126.9025880	1.02
1127.6530760	0.47
1129.7073970	0.15
1134.1791990	1.08
1136.7492680	0.38
1137.8059080	0.11
1138.4309080	0.17
1140.9587400	0.32
1143.0246580	0.45
1144.0761720	1.40
1145.6745610	0.12
1148.3286130	0.10
1149.0334470	0.59
1153.2893070	1.36
1154.4934080	0.74
1158.9744870	0.09
1160.4150390	0.38
1161.9370120	1.63
1164.0432130	0.34
1164.9282230	1.51
1167.0239260	0.13
1168.1217040	0.26
1169.9884030	0.12
1171.2500000	0.85
1172.1049800	0.61
1173.6499020	1.16
1175.9233400	2.06
1176.5954590	0.83
1177.5902100	0.43
1178.2387700	0.40
1179.6850590	0.52
1180.8006590	1.76
1181.5971680	0.55
1183.1086430	0.73
1183.8542480	0.09
1184.6899410	0.06
1185.8784180	0.92
1186.6267090	1.84
1187.7155760	0.92
1189.1770020	2.67
1190.0385740	1.84
1190.9482420	2.02
1191.6030270	0.95
1192.3204350	0.25
1193.0783690	2.40
1193.8886720	2.32
1194.9948730	2.22
1196.3090820	4.62
1196.9279790	4.17
1199.0446780	1.43
1199.6950680	3.05
1200.6894530	0.20
1201.3823240	1.30
1202.0739750	0.24
1203.6773680	1.76
1204.4243160	0.53
1205.0777590	0.07
1206.2827150	1.11
1207.2309570	4.89
1208.4523930	0.86
1209.4816890	1.34
1210.3460690	4.04
1211.3521730	2.77
1212.1032710	1.13
1213.7175290	7.73
1214.5524900	0.68
1216.7677000	7.32
1217.9899900	0.55
1219.0598140	1.97
1219.7373050	0.66
1222.0668950	2.39
1224.9721680	0.23
1228.4090580	0.54
1231.5279540	0.32
1239.4448240	0.09
1249.4935300	0.08
1250.4416500	0.42
1280.3889160	0.14
1285.1726070	0.47
1285.8521730	0.46
1291.2929690	0.16
1299.2097170	0.19
1299.9124760	0.52
1305.0440670	0.28
1315.0018310	1.15
1317.5063480	0.23
1318.5620120	0.10
1322.2645260	0.14
1329.7554930	0.16
1331.7442630	0.12
1333.5166020	0.15
1335.0372310	0.12
1340.6496580	0.29
1344.7271730	0.14
1349.5477290	0.14
1350.2437740	0.06
1353.3946530	1.00
1355.7021480	0.11
1356.7462160	0.10
1358.2720950	1.81
1364.5677490	1.50
1366.4014890	0.45
1372.6739500	0.27
1373.4847410	1.34
1374.6197510	0.10
1376.0797120	0.29
1381.4597170	0.36
1383.8314210	0.59
1391.1651610	0.57
1397.3503420	0.69
1398.3405760	0.33
1399.7915040	0.31
1407.9725340	0.51
1408.7689210	0.22
1414.8356930	1.00
1423.8001710	0.70
1430.0521240	1.00
1435.1274410	0.54
1440.2520750	0.86
1442.5900880	1.02
1443.4008790	0.38
1447.2590330	0.77
1448.5437010	0.36
1450.4552000	1.05
1453.9827880	0.55
1454.8702390	0.67
1456.3717040	0.60
1458.3795170	0.62
1459.0731200	0.57
1461.6468510	0.12
1464.5169680	0.19
1465.7840580	0.75
1466.6545410	0.27
1468.8675540	0.59
1472.3353270	0.55
1475.5003660	1.36
1476.1397710	0.28
1479.2774660	0.60
1481.5081790	0.40
1482.7860110	0.76
1488.9675290	0.34
1490.5091550	0.69
1491.3010250	0.94
1494.5010990	0.32
1500.4616700	0.80
1512.0465090	0.17
1513.8128660	0.90
1518.8433840	0.45
1521.0805660	0.60
1530.6881100	0.11
1536.3048100	0.28
1543.0484620	0.08
1546.6556400	0.21
1548.2574460	0.48
1553.5063480	0.34
1562.6104740	0.52
1568.3092040	0.40
1577.6663820	0.48
1579.9075930	1.24
1582.0321040	0.45
1588.9012450	0.66
1606.5535890	0.15
1615.8879390	0.32
1619.8884280	0.07
1621.9206540	0.54
1622.5435790	0.50
1629.0886230	0.13
1641.1968990	0.41
1665.2199710	0.36
1674.3343510	0.09
1678.1492920	0.25
1681.3267820	0.07
1706.7244870	0.24
1708.0509030	0.38
1713.0281980	0.09
1722.7132570	0.18
1735.9476320	0.38
1746.9870610	0.28
1752.3518070	0.06
1753.9168700	0.21
1755.6636960	0.46
1777.4782710	0.73
1780.4040530	0.21
1781.4979250	0.20
1802.3518070	0.65
1819.1130370	0.40
1822.1551510	0.26
1825.1085210	0.22
1830.8220210	0.41
1849.8171390	0.51
1853.8962400	0.30
1860.6013180	0.10
1868.0568850	0.40
1873.5531010	0.70
1874.9815670	0.15
1877.9484860	0.23
1890.5583500	0.16
1894.1468510	0.22
1898.1134030	0.13
1911.9940190	0.04
1917.2146000	0.06
1927.1193850	0.10
1930.4139400	0.17
1952.8670650	0.26
1954.8328860	2.09
1956.1799320	0.09
1961.9470210	1.62
1964.2813720	0.05
1966.1229250	0.08
1979.7674560	0.11
1983.4825440	0.26
1990.0266110	0.13
1999.4084470	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	292.1244
Annotation	Unknow
Peak:m/z	Relative Intensity
89.9712677	0.82
116.0229340	30.97
133.8855896	3.10
144.9954529	1.45
158.2129059	0.30
167.1854858	0.29
169.6925049	0.62
175.1809387	2.08
176.9549866	100.00
187.9820251	0.80
190.9456482	0.21
200.7463074	0.23
201.5378113	0.67
229.1165771	0.35
231.9613342	0.48
236.3467102	0.46
246.0199890	3.02
252.4987183	2.12
256.0452576	1.77
261.9511414	0.21
272.6495972	0.10
273.8346558	3.62
274.4451904	0.43
275.1575317	0.35
282.6561279	5.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	283.03
Annotation	Unknow
Peak:m/z	Relative Intensity
94.9870834	0.24
109.0961304	0.19
120.9864960	0.12
135.0637817	0.13
136.5235138	0.46
149.1416016	0.59
150.7230225	0.21
162.9574127	0.12
164.9590149	0.17
169.0013885	0.17
171.2277527	0.16
187.1040955	0.25
200.7579041	0.33
203.0327454	0.13
208.8061829	0.22
210.9941406	0.13
225.1937866	0.45
227.1546936	0.23
236.1950073	0.09
237.2909241	0.15
239.3480225	0.23
242.0023193	100.00
247.2770996	0.25
255.1109619	0.35
259.7889404	18.78
261.9725952	0.28
262.7244263	0.21
265.1289978	1.00
267.0369263	0.14
271.2377930	0.35
273.3150024	0.41
274.6279907	0.12
280.3938599	0.49
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	357.2494
Annotation	Unknow
Peak:m/z	Relative Intensity
112.1322327	0.12
123.9730453	1.89
129.0284119	1.62
130.0818176	0.13
142.0703125	3.58
151.9959106	4.58
155.9827118	0.26
165.1546936	0.13
167.0293884	0.17
169.1564789	1.08
170.0103455	4.33
175.2292938	0.12
179.0559082	0.21
183.1037598	0.07
197.1979675	1.33
207.3646088	0.14
208.9862213	0.75
211.5627441	0.26
212.6940765	0.22
213.8367004	0.09
215.0357361	2.07
223.8706665	0.30
225.2656250	0.05
226.2832642	0.69
228.1815186	1.13
229.2242737	100.00
234.7256165	0.19
240.3248596	0.39
242.2869873	0.50
242.9884949	0.32
252.0714722	0.65
253.3271484	0.10
258.2513123	5.93
262.5368958	0.06
270.2269287	1.65
272.4541626	0.55
280.1577454	3.06
281.1965942	0.34
282.7980957	0.44
293.1641846	0.12
294.1498108	0.33
298.1963196	36.36
310.5488892	0.35
314.6434326	0.08
321.3450317	0.07
339.2968750	2.39
340.0570679	0.47
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	277.1024
Annotation	C20912
Peak:m/z	Relative Intensity
83.9342499	1.73
101.9701996	1.60
130.0427551	14.05
130.9021912	0.34
147.9225922	100.00
148.6721802	0.04
154.1780243	0.08
172.9929504	0.06
195.1908875	0.04
196.9574890	0.19
214.0445557	1.87
227.6998596	0.13
231.0908508	0.75
232.9609680	0.24
235.2584229	1.75
236.1090088	0.21
236.7818604	0.08
241.0285645	0.65
244.8781128	0.18
257.0503845	0.11
259.0982666	5.19
260.1190186	7.68
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	658.0198
Annotation	Unknow
Peak:m/z	Relative Intensity
185.8992462	0.10
203.9052429	0.52
210.0272064	0.06
216.0776367	0.14
220.1124268	0.26
234.8046417	0.21
236.0742493	0.57
243.9971771	0.06
245.0776520	0.18
245.9539185	0.37
253.2398376	0.09
258.0430908	0.45
261.0215759	0.12
262.0380859	0.07
273.9107361	0.05
274.8988647	0.21
275.9035950	0.43
276.9964600	0.06
277.7846680	0.07
281.3015137	0.35
283.9505615	1.99
288.3284302	0.20
290.0939636	0.17
291.8696594	0.07
295.0181580	0.17
304.0097656	0.27
305.0998535	0.04
307.0441895	0.39
308.3385620	0.26
309.0568848	0.12
311.1265869	0.13
315.2905273	1.56
315.9816284	1.30
319.9468384	0.40
325.1327515	0.19
325.9682617	0.15
329.0653076	0.14
331.3020630	0.34
332.3577271	0.59
333.0761719	1.49
334.3548584	0.41
337.9683838	0.35
346.0673828	0.44
347.0649414	0.60
347.9266357	0.37
350.9403687	0.11
355.6625366	0.05
356.9945068	0.23
361.9939575	0.12
363.3049316	0.06
364.0344849	0.07
365.0787964	2.58
366.0510864	0.18
366.9780884	0.14
372.0617065	0.12
378.2672729	0.08
379.1245728	0.10
379.9674072	2.39
381.0210571	2.02
382.1295776	0.99
393.6693726	0.17
395.9673462	0.14
396.9824219	1.04
397.9886475	6.98
398.9370728	0.79
404.9172363	0.22
415.0214233	1.94
415.9731445	1.44
424.0457764	0.18
427.6406860	0.24
429.2239380	0.74
435.3295288	0.06
436.0009766	0.07
436.7788696	0.15
443.1802368	0.06
445.0888062	0.23
446.1317749	1.26
447.0327148	1.73
448.1566772	2.88
451.6421509	0.06
454.4685059	0.21
457.8364868	0.06
462.0739136	0.72
462.9578247	2.01
464.0421753	1.98
465.1185913	0.17
474.2795410	0.11
477.8416138	100.00
478.6094360	0.48
480.0148315	0.30
493.9837036	0.05
495.0552368	1.92
496.0671997	5.50
506.0815430	0.40
509.0245361	0.34
511.4356079	0.25
517.7803345	0.05
526.9432373	3.98
528.0143433	0.06
529.4529419	0.17
539.7841797	0.11
548.8333130	0.84
549.9168701	0.09
554.7092285	0.23
559.5403442	0.37
560.3344116	0.14
564.7009277	0.11
567.4613037	0.10
568.3507690	0.31
573.9970093	0.18
577.0857544	0.33
577.8637085	0.35
593.3814697	0.12
595.3596191	0.07
597.7249146	2.07
598.9248047	0.91
609.6527710	0.15
613.2646484	0.09
621.7666626	0.24
637.3713379	0.38
638.0802612	0.10
638.9102173	0.67
640.0388184	2.15
640.8494263	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	346.0557
Annotation	dGMP
Peak:m/z	Relative Intensity
131.1800385	0.29
131.9510345	0.24
134.0423584	1.59
139.0075226	0.86
150.9496002	8.07
153.1540680	0.15
171.0966339	0.61
175.0105286	1.02
192.8517761	7.30
194.0979309	0.40
199.0907135	0.60
199.9207153	0.43
201.9564056	0.76
207.1549530	0.52
211.0436401	100.00
214.0934143	1.09
230.3387756	0.18
241.6881409	0.45
251.9665833	0.21
262.1493835	10.66
286.0200195	0.21
302.1898193	0.49
303.1485291	1.78
327.2868652	0.28
327.9890137	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	543.1389
Annotation	Unknow
Peak:m/z	Relative Intensity
202.9019012	0.04
240.7499695	0.11
283.2696533	0.14
303.2499084	0.06
305.9166260	0.09
311.2276001	0.03
319.0897217	0.16
336.5472412	0.14
339.4064331	0.02
353.1397095	0.03
356.2077026	0.05
357.4586792	0.08
363.3683472	0.16
370.2340698	0.04
376.2821655	0.04
381.2329712	0.05
407.1273804	0.06
411.4375000	0.19
413.4204102	0.03
414.3456421	0.07
419.3286743	2.81
426.8863525	0.08
427.5979614	0.12
429.3142700	0.06
439.3059692	1.10
441.2102051	0.09
445.0316162	0.08
446.2030640	0.04
447.1697388	0.25
453.2866211	0.09
457.2789917	15.57
459.1601562	0.14
461.8476562	0.16
463.1514893	0.08
468.8358154	0.05
481.3345337	0.04
482.2471313	0.07
486.2480469	0.08
497.0343018	0.16
499.2289429	100.00
499.8435669	0.37
507.5648193	0.10
512.3164673	0.09
524.6663208	0.93
525.3220825	2.62
526.3684692	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	306.0764
Annotation	Glutathione
Peak:m/z	Relative Intensity
96.7765884	0.05
97.9541931	0.11
99.2005615	0.05
101.0428467	0.06
115.8525696	0.04
120.1495819	0.17
123.0108261	0.07
125.0299377	0.06
126.0365219	0.23
128.0179749	9.43
129.9671936	0.28
143.0786591	9.97
145.0610352	0.17
145.9647827	0.98
150.1885834	0.04
152.1359558	0.24
153.0103149	0.07
155.1729431	0.07
160.0556488	11.11
161.2239990	0.08
161.9223633	0.07
163.1768646	0.07
166.1635437	0.16
166.8998566	0.23
168.7740479	0.19
169.9656067	0.04
171.0705109	1.05
172.2103882	0.04
177.0579529	10.27
179.0303955	10.42
181.0783997	0.08
185.1282043	0.86
187.1860352	0.03
187.9544983	0.20
189.0454407	0.76
190.3650513	0.05
192.1811066	0.14
197.0369720	0.58
199.8320618	0.11
201.0456543	0.09
203.1962585	1.84
204.2215271	0.38
206.6548157	0.10
207.9819641	0.11
210.1020813	7.34
211.2407227	0.09
212.9917908	0.73
214.1369324	0.31
215.4755249	0.10
218.0579834	0.06
219.0877380	0.08
224.1385193	0.07
225.2953186	0.06
226.2677917	0.43
228.2868042	0.72
231.1171570	1.64
233.2535095	0.04
236.1542053	0.69
242.1701050	1.54
243.2065430	0.06
243.8223877	0.18
247.1172180	0.04
251.2831421	0.05
254.1311340	85.70
259.0485840	0.18
260.2412415	0.35
262.2622375	0.92
268.0799561	0.05
269.0253601	0.22
270.1307373	0.41
272.1204834	100.00
276.1134338	0.38
277.1546021	0.28
278.3553162	0.09
288.0528564	65.73
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	723.1448
Annotation	Unknow
Peak:m/z	Relative Intensity
213.1044312	0.03
272.3593140	0.17
278.9542236	0.29
280.8844910	0.02
288.2466736	0.16
336.2204590	0.32
339.0530701	0.04
354.4836426	0.05
395.3126221	0.10
404.3502808	0.25
428.2075195	0.03
451.3430176	0.11
460.0088501	0.23
469.2777710	0.03
473.1188965	0.08
485.4473877	0.16
488.5667725	0.26
492.3821411	0.35
493.4792480	0.07
495.2561035	0.05
508.3200073	0.05
523.4634399	0.08
541.4215088	0.03
543.6465454	0.48
548.2879028	0.09
549.2826538	0.06
558.1870117	0.11
574.6325073	0.30
576.0352783	0.09
584.0377808	0.07
590.1749878	0.14
594.1118164	0.11
599.3128052	0.41
599.9262695	0.19
602.0408936	0.07
604.0900269	0.08
604.7120972	0.04
605.5001221	0.19
607.4448853	0.85
608.4761353	0.26
609.4620972	0.03
617.2922974	0.04
630.3451538	0.05
631.0812378	0.62
638.7894897	0.04
642.3204956	0.19
644.8875122	0.31
646.4761353	0.11
648.4841919	0.10
650.2090454	0.11
651.0941772	0.19
652.4635620	0.03
655.9258423	0.45
656.6256714	0.24
659.5304565	0.02
661.4096069	0.15
664.4570923	0.91
665.7384644	1.94
666.7428589	0.05
667.7752686	2.00
669.3769531	0.52
670.0594482	0.21
673.9942017	0.03
680.0084839	0.07
683.1453247	0.44
683.8476562	0.09
684.7798462	0.56
685.9685059	0.09
687.3036499	0.19
690.4046021	25.89
691.4489746	2.12
692.2835083	0.94
692.9548950	0.33
694.0695801	0.18
695.1511841	0.81
695.9369507	0.27
696.6038818	0.05
698.2907104	2.89
702.4934692	2.42
703.3803101	0.03
704.4890747	0.02
705.3773193	0.14
708.4714355	2.83
709.4825439	0.41
710.9129028	0.34
711.5737915	0.19
712.7515259	0.32
713.8377686	0.31
716.6801147	0.03
735.8800049	0.24
743.5238037	0.31
745.5782471	0.07
747.8270874	0.74
752.3999634	6.85
753.3520508	0.38
754.0436401	0.19
757.3751831	0.39
763.7796021	0.12
766.8986206	0.03
770.0413208	0.06
776.2440796	0.26
776.8711548	0.40
780.8017578	0.41
781.4586182	0.71
783.2698975	1.10
789.8370972	0.20
790.6304321	0.04
793.4674072	0.38
800.6809082	0.04
805.0652466	0.94
807.4956055	0.77
808.4631958	0.20
810.7958984	0.23
813.0878296	0.68
814.7587891	0.05
815.8524780	0.93
816.6334839	0.37
817.2688599	0.09
820.1885376	12.31
820.9235229	0.88
821.6543579	0.06
822.6857300	0.12
824.6618042	0.25
825.3989868	0.29
827.4136353	0.22
828.7213745	0.08
829.9465332	2.73
830.9760132	0.19
832.7344971	0.17
834.5220947	40.02
835.5524902	0.07
836.4784546	0.41
837.9732056	0.04
839.4225464	0.07
840.4702759	2.85
841.2324829	0.30
842.6989136	0.02
846.5386963	0.08
847.3079224	0.05
849.7553101	0.16
851.4013062	0.92
853.8351440	1.26
855.8400269	12.58
858.1790771	4.90
858.9110107	1.21
859.5967407	0.03
860.8861694	0.04
862.7448730	100.00
864.0994263	1.59
865.0225830	0.81
865.8646851	0.26
866.5752563	0.14
867.6286011	0.28
868.5374146	0.29
869.6692505	0.05
874.1836548	2.80
874.8230591	0.51
887.5371094	0.17
893.0459595	1.24
893.6797485	0.02
894.5873413	0.18
896.4093628	0.35
901.0812988	0.26
901.7290039	0.14
907.2121582	0.10
910.6784058	0.10
914.5161133	0.02
916.2623901	0.04
919.5912476	0.13
921.6279907	0.07
926.6793823	0.38
929.9692993	1.20
930.5812988	0.16
931.3630981	0.08
936.1318970	9.66
937.1008911	0.25
938.0678101	0.05
947.5149536	0.06
948.9292603	0.31
951.3208618	0.04
963.3620605	0.20
968.9130249	1.11
969.6750488	1.79
972.7048950	0.04
975.3410034	0.07
975.9479980	0.07
980.7354126	0.04
981.7843628	0.06
987.9152222	0.06
988.7431641	0.09
990.7301636	0.10
992.6594238	0.34
993.3877563	0.09
1002.9821780	0.25
1011.1948240	0.18
1019.9630740	0.07
1020.5842290	0.06
1031.9595950	0.22
1041.4653320	0.25
1042.4003910	0.26
1051.4517820	0.04
1052.3715820	0.06
1063.3737790	0.05
1081.2062990	0.09
1087.3189700	0.36
1092.4877930	0.24
1093.6252440	0.24
1094.5750730	0.12
1098.4610600	0.04
1103.0686040	0.21
1106.5368650	0.43
1112.2836910	40.24
1113.3249510	0.35
1114.3652340	0.32
1115.0593260	0.03
1116.0993650	0.15
1121.7978520	0.04
1122.5727540	0.06
1127.8013920	0.13
1128.6489260	0.28
1137.8748780	0.30
1139.5335690	0.03
1151.9658200	0.06
1163.7879640	0.03
1165.6556400	0.16
1173.0960690	0.09
1174.2678220	0.23
1174.9873050	0.07
1179.9614260	0.03
1181.1447750	0.06
1183.7575680	0.06
1193.8527830	0.03
1215.8264160	0.06
1216.8735350	0.08
1247.4356690	0.07
1251.0025630	0.04
1264.3494870	0.03
1278.0816650	0.08
1280.6990970	0.09
1292.5148930	0.04
1302.6656490	0.06
1311.4317630	0.30
1346.5800780	0.08
1355.3657230	0.07
1366.8875730	0.07
1376.7584230	0.30
1389.5423580	0.14
1398.3793950	0.15
1416.5764160	0.04
1417.4997560	0.20
1418.7286380	0.06
1434.5610350	0.12
1481.5821530	0.02
1500.0494380	0.09
1514.5211180	0.10
1521.9770510	0.03
1599.0987550	0.18
1608.1214600	0.05
1635.7762450	0.08
1643.5533450	0.11
1663.7781980	0.06
1678.9128420	0.07
1714.7357180	0.08
1739.3934330	0.06
1741.7974850	0.06
1778.1429440	0.05
1783.4002690	0.09
1785.2679440	0.03
1815.8944090	0.05
1817.8592530	0.14
1818.8424070	0.18
1831.5574950	0.04
1839.0500490	0.08
1840.3270260	0.02
1844.2686770	0.12
1847.9558110	0.26
1860.9356690	0.61
1865.1451420	0.04
1868.2034910	0.09
1878.6246340	0.03
1885.8175050	0.21
1897.9539790	0.04
1902.1907960	0.17
1916.0064700	0.10
1935.9348140	0.24
1944.3283690	0.07
1947.8073730	0.15
1950.4021000	0.45
1952.0432130	0.96
1959.4337160	0.38
1963.2977290	0.10
1964.3927000	0.38
1967.5246580	0.18
1972.9927980	0.04
1974.5521240	0.52
1976.4759520	0.73
1981.2320560	0.75
1984.6218260	1.38
1991.3356930	5.82
1994.1507570	0.03
1995.8763430	0.18
1996.9136960	0.54
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	604.1724
Annotation	Unknow
Peak:m/z	Relative Intensity
172.1477509	0.18
172.9630280	0.48
175.1310272	0.18
178.9983063	0.06
187.9863129	0.39
189.1164856	0.13
198.9683380	0.15
200.1072083	1.17
201.9879150	8.09
205.0762787	0.22
209.0395203	0.03
211.1675262	0.03
215.0413971	0.40
218.0730896	1.97
219.1878510	0.46
219.8587646	0.06
221.1232605	0.14
223.0359650	0.05
227.3977661	0.10
233.2873230	0.06
244.0925903	0.35
246.1009521	0.09
247.1775818	0.45
249.2225494	0.16
259.9974365	0.05
262.1066895	100.00
263.0952148	0.62
264.2169189	0.21
265.1560974	3.52
283.2194214	2.71
289.1440430	0.06
297.2849731	0.10
299.1495361	0.16
305.0079956	0.10
317.1565552	1.82
318.3720093	0.16
321.0921021	0.17
329.1653442	0.55
339.1404419	0.06
340.0598145	0.19
341.2288818	0.06
344.9165039	0.05
346.8723145	0.14
349.1671753	0.52
359.0966187	0.05
361.2106323	0.12
362.4073486	0.23
363.1540527	0.04
368.7575684	0.03
377.3122559	0.59
378.1664429	0.09
380.1987915	0.13
381.3798218	0.11
383.0458374	0.74
384.0320435	0.10
389.9899292	0.13
391.0933838	0.05
393.2408447	0.23
394.5247803	0.17
397.3311157	0.82
402.3184204	0.06
409.3463135	0.23
411.2655640	0.21
412.0989990	0.61
413.3281860	0.17
415.2203979	3.24
421.2283325	0.04
423.8218994	0.13
428.5554810	0.04
432.5335083	0.09
440.3883667	0.11
442.1058350	0.51
454.1772461	0.06
455.3471069	0.11
457.1594238	0.16
457.8513184	0.09
471.3472900	1.39
472.2294922	1.85
473.0864868	0.56
484.3961792	0.06
485.3453979	0.37
494.2652588	0.13
506.4418335	0.05
507.3964844	0.18
511.2979126	0.33
512.1666870	0.21
514.1148071	0.15
516.0717773	0.04
525.3330078	0.23
526.4368286	0.92
527.6092529	0.03
529.1589966	1.08
531.6242065	0.13
544.2625732	5.11
545.3600464	0.99
555.5551147	0.23
561.0299072	0.51
562.2745972	0.21
573.2449341	19.38
573.8818970	0.07
585.8850708	0.16
587.2000122	1.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	290.85
Annotation	gamma-Pentachlorocyclohexene
Peak:m/z	Relative Intensity
122.8545532	1.59
139.9723206	0.06
202.9642334	0.16
206.7728577	100.00
223.0041809	1.26
226.0620728	0.11
244.8223267	0.33
273.0032959	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	501.16
Annotation	Nocardicin B
Peak:m/z	Relative Intensity
177.0168457	0.76
191.1583862	0.03
195.0077515	0.10
225.9581909	0.05
243.0330658	4.73
254.9384460	0.30
260.9112854	0.02
268.7281189	0.26
283.6580811	0.04
292.0227051	0.04
297.1240845	1.28
300.3713989	0.03
306.0817566	0.25
308.1483459	0.05
309.1746826	0.07
321.0617065	0.32
332.0806885	0.05
335.4700317	0.06
339.1128540	1.35
354.0433655	0.20
355.1488647	0.09
372.0577393	100.00
372.6767883	0.19
426.1275940	4.80
428.4599915	0.01
435.4370728	0.02
436.4065247	0.05
440.5292358	0.04
444.1517639	0.05
451.6459656	0.13
452.4369202	0.06
464.5769348	0.04
465.1941223	0.05
482.2418823	0.02
483.2626648	0.47
484.1925659	0.06
492.2232971	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	526.1415
Annotation	Pityriarubin C
Peak:m/z	Relative Intensity
159.9207306	1.02
172.8798523	0.11
190.0507050	0.09
190.9040833	0.07
192.4962311	0.08
202.9675751	0.48
220.9403534	4.12
238.0050354	3.49
251.0252380	0.04
256.0236816	0.25
263.4066467	0.13
276.0748291	0.14
284.3325806	0.07
292.0559082	0.48
293.6791992	0.18
303.5629272	0.41
308.2890015	0.20
331.0003052	0.09
336.1680298	0.11
349.1077271	0.16
352.3569946	0.08
355.2220459	0.31
364.1837769	0.05
367.1552124	100.00
369.9884644	0.06
379.0980835	0.10
382.0645752	0.12
385.3107910	0.05
392.5465698	0.27
395.2595215	0.14
397.0154419	3.29
410.4936523	0.64
427.5364380	0.33
432.4827271	0.15
434.5545654	0.22
435.8887939	0.52
440.4545898	0.09
441.0906372	0.07
444.7280884	0.27
449.8198242	0.07
450.4685059	0.20
462.7797852	0.13
463.5135498	0.20
464.9426270	0.22
470.0251465	0.22
471.3062134	0.07
472.4522095	0.16
480.1643677	0.25
482.1473999	0.13
483.0949097	0.14
485.1474609	0.19
490.1845093	0.83
504.3898926	0.32
507.2579956	0.82
508.0590820	1.62
510.1782837	0.11
515.7157593	0.58
516.4755249	0.92
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	317.1366
Annotation	Unknow
Peak:m/z	Relative Intensity
92.2067871	0.02
103.9299316	0.53
105.9788284	0.02
126.0490723	0.02
135.9658203	0.10
148.0341797	15.75
161.9741211	0.07
167.9198914	0.07
180.0566406	0.09
185.1171722	0.06
187.1124878	0.09
200.1985474	0.05
203.1395874	0.04
207.1747131	0.03
221.3027649	0.07
230.1717529	0.01
232.1165771	1.71
237.2050781	0.04
242.9768982	0.02
244.1360779	0.02
246.1636963	0.02
247.2090149	2.11
248.2454224	0.73
253.4292603	0.01
254.9931335	0.05
258.1588135	0.63
259.2969971	0.05
271.0460510	0.08
275.0961304	100.00
283.0596313	0.02
299.1374817	0.32
300.1844482	2.89
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	651.1125
Annotation	Oxidized glutathione
Peak:m/z	Relative Intensity
218.9092560	0.09
237.2434235	0.18
248.8608398	0.53
294.1487122	1.44
295.3603516	0.05
299.7786865	0.19
312.0313721	0.32
326.0053101	0.48
328.0806274	0.15
336.1109009	0.26
338.2910156	0.05
344.1195679	0.22
345.9160767	0.09
348.9932251	0.05
351.2012329	0.03
360.0017700	0.60
378.1255493	7.37
378.7998657	0.13
393.1815796	18.34
401.1680298	0.07
402.1393433	0.16
408.3388672	0.28
426.3826904	0.10
429.0083618	0.29
439.7431030	0.08
440.8926392	0.30
451.3515625	0.03
465.1899414	2.87
484.5631104	0.06
504.2196045	6.85
505.1867065	0.13
506.1337891	0.03
518.1929321	0.21
522.1531982	100.00
522.8130493	0.36
540.0696411	0.04
552.9929810	0.15
558.1103516	1.90
573.3986206	0.12
576.0364380	0.20
599.1189575	0.18
615.4857178	0.10
633.1788330	31.92
634.3421021	1.04
635.1060181	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	203.08
Annotation	Ethotoin
Peak:m/z	Relative Intensity
71.9761658	0.48
73.9580078	1.39
115.9441528	30.33
116.5622864	0.11
128.0722198	0.49
128.9760590	0.17
130.0707703	0.80
132.0918274	0.34
142.0871124	15.34
144.1604156	0.05
157.1356964	0.19
159.0107574	100.00
173.0261078	2.19
175.2575531	0.04
185.2368927	1.03
186.0372162	9.37
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
180.9699402	0.14
206.9098969	1.09
213.0296936	1.72
215.8946838	1.19
223.0543213	3.66
251.2697754	0.77
258.0746460	1.31
274.7575989	100.00
290.7870483	28.85
340.4166260	0.52
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	263.1416
Annotation	Methionyl-Leucine
Peak:m/z	Relative Intensity
85.8847656	3.45
131.9606476	100.00
132.9116211	0.09
135.9927216	0.05
148.9980469	0.05
173.0397797	0.02
183.8625336	0.17
187.2307281	0.09
188.8014069	0.05
190.9997711	0.28
206.9800262	0.16
215.0470123	0.04
216.3541870	0.05
217.0965729	0.12
227.2259827	0.07
228.2595978	0.20
239.6650543	0.05
245.0913086	1.33
246.1339111	0.15
247.1187592	0.07
248.2619171	0.08
262.2990723	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	385.11
Annotation	Unknow
Peak:m/z	Relative Intensity
145.9923096	2.96
148.2171478	0.31
156.7088928	0.74
157.8876495	1.08
170.8183899	0.72
178.0821838	0.69
190.0859375	2.14
207.2534943	1.22
220.1798096	5.83
223.0426331	100.00
235.1477661	0.38
239.3014526	0.67
252.0605164	13.74
253.0542603	12.68
265.0839844	3.52
289.2234192	0.77
295.2756958	0.43
331.0626831	5.87
349.0066528	2.33
352.2166138	4.13
367.1194153	11.79
368.2377625	2.16
385.8115234	0.52
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	544.82
Annotation	Unknow
Peak:m/z	Relative Intensity
192.2107849	0.04
207.0449677	0.04
208.9416199	0.31
284.1340637	0.07
290.7284546	2.43
292.8246460	8.55
334.0343628	0.06
344.6945190	0.08
349.8349609	0.04
351.9887695	0.14
355.3957520	0.08
368.7740479	0.07
374.7849121	2.23
376.7920532	19.82
379.0122070	0.02
382.0968018	0.14
383.0870972	0.03
383.9995728	0.10
391.0870972	0.12
393.2125244	0.15
395.0800781	0.07
398.6202393	0.02
401.3574829	0.25
402.0745850	2.68
408.0908203	0.04
409.1724854	0.13
411.7459717	0.12
413.0946655	0.14
414.7843628	0.61
415.9735718	0.08
418.0165405	0.12
420.1279907	0.03
422.0671997	0.23
423.3015137	0.35
424.2962646	0.06
425.0015869	0.04
456.2740479	0.10
458.6101074	7.41
460.6062622	100.00
461.3659668	0.29
469.2941284	0.03
470.0531616	0.03
475.5227661	0.07
476.6694946	0.07
479.6754761	0.11
484.6613159	0.22
494.8251343	0.06
496.0799561	0.06
498.7657471	11.05
500.3129883	0.04
508.1217041	0.15
509.3044434	0.06
514.1857300	0.03
519.7539673	0.22
522.2311401	0.06
526.7222900	0.28
527.8567505	0.37
528.4594727	0.06
529.0983887	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	481.1039
Annotation	Unknow
Peak:m/z	Relative Intensity
137.9181519	0.09
152.8953705	0.04
170.9680481	0.22
177.8118896	0.05
181.0471191	0.14
184.0675812	0.25
199.0072021	0.76
205.0978394	0.21
213.3738708	0.08
218.2665710	0.04
231.0067749	0.39
250.9421387	0.04
265.0276184	0.30
270.3999329	0.09
277.1902161	0.07
288.9611816	0.18
301.4150391	0.20
305.6290283	0.08
307.1389465	0.06
308.0125122	0.11
316.2196655	0.04
317.1916199	0.28
319.2125244	5.19
322.3361206	0.09
323.3186035	0.07
324.0694580	0.21
326.2909546	0.08
334.0687256	2.30
335.0329590	2.56
346.9962158	0.07
352.0668945	100.00
352.6919861	0.21
365.0527344	0.02
369.0435181	0.07
371.2983093	0.13
381.1908875	0.12
385.9203491	0.15
390.8543701	0.05
397.7592468	0.12
417.9776917	0.20
420.5637207	0.19
427.2012634	0.05
434.9624939	0.08
440.2010193	0.09
445.2713318	0.11
453.2960510	0.04
463.2388306	8.87
464.2320251	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	147.08
Annotation	3-Ureidoisobutyrate
Peak:m/z	Relative Intensity
83.8292694	0.02
100.8930664	1.35
128.7258606	0.05
129.9327240	100.00
147.7464752	0.03
170.7495728	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	330.1173
Annotation	Lithospermoside
Peak:m/z	Relative Intensity
94.0517044	0.09
106.1172562	0.12
121.8948669	0.13
136.1270447	0.15
149.9412537	31.45
166.2247314	0.22
167.9894104	100.00
178.5049744	0.12
185.9649506	0.19
207.5820923	0.04
224.3099365	0.06
244.1833801	0.07
254.0061646	0.04
266.1737671	0.24
283.9837341	0.13
312.0742798	0.15
320.7517090	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	541.1129
Annotation	Larixinol
Peak:m/z	Relative Intensity
179.2878418	0.05
208.0465088	0.03
209.2276459	0.04
225.0845184	0.03
254.2173157	0.31
258.9365540	0.05
263.1320190	0.03
272.2250977	1.34
273.2387695	0.10
275.0686340	0.04
277.2257690	0.06
288.2843018	0.11
289.0073853	0.03
304.0847778	3.32
305.1984253	0.24
306.1856689	1.87
307.1639404	0.28
326.9741211	0.03
331.0869751	0.23
332.1532593	0.10
338.0281982	0.06
343.4155273	0.20
359.9825439	0.03
361.5342407	0.04
366.1788330	0.03
379.6645508	0.12
380.9880981	0.23
385.0596924	0.07
393.7716064	0.04
395.4650269	0.05
403.3659058	0.06
411.1424561	0.08
416.0486450	0.03
419.3248291	0.04
423.3722534	0.13
424.3348389	0.13
426.4754028	0.08
428.1631470	0.07
434.7832031	0.09
449.6592407	0.07
452.1224365	0.03
454.3975220	0.19
455.2728271	0.92
461.1842651	0.14
463.2202148	1.24
476.4851685	0.07
479.4008179	0.08
481.3756104	0.03
492.0734863	0.03
492.9528198	0.04
495.1430054	0.81
497.1638794	100.00
497.8342285	0.05
504.1541138	0.20
505.3328247	0.13
507.3521729	0.02
509.2062378	0.06
518.3457642	0.16
521.0694580	0.18
522.3292236	0.81
523.2738647	0.37
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	885.2661
Annotation	Kaempferol 3-isorhamninoside-7-rhamnoside
Peak:m/z	Relative Intensity
247.0836182	0.08
259.0550537	1.23
265.0925293	0.03
277.2204285	0.13
289.2232361	0.22
301.2277832	0.42
304.9181213	0.07
319.1932678	0.09
331.3292236	0.05
385.3339844	0.04
396.2664795	0.12
408.9915161	0.06
439.0375366	0.13
440.6186523	0.27
453.4332275	0.20
457.3309326	0.07
469.2162476	0.08
481.4003296	0.15
485.3587646	0.13
487.2549438	0.56
499.2782593	35.12
511.3873901	0.10
515.1298218	0.04
517.0256348	0.11
529.0686646	0.11
556.6328735	0.10
561.2039795	0.04
608.3604126	0.05
663.0704956	0.04
664.7786255	0.07
670.4432983	0.05
687.1230469	0.06
689.1511230	0.28
723.1091309	100.00
723.7706909	0.33
729.4774780	0.03
746.6574097	0.04
765.1978760	0.83
800.5910034	0.09
802.4369507	0.39
819.6697388	0.04
822.2515259	0.06
838.4242554	0.11
839.6743164	0.05
841.1544189	0.18
853.4942627	0.04
857.7564087	0.08
858.6372681	0.28
862.5625610	0.15
867.0473022	0.98
867.8397827	0.09
869.8661499	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	463.0479
Annotation	4-Hydroxyglucobrassicin
Peak:m/z	Relative Intensity
131.9663544	0.37
137.0887756	0.18
139.0078278	0.70
144.0133057	0.30
145.2526703	0.09
147.9185486	0.59
155.6936340	0.22
156.8437805	0.10
158.1768188	0.35
160.0561066	6.88
163.0023346	0.26
166.9298248	0.14
169.0834198	2.85
170.0412292	1.40
176.1190033	3.97
185.1113892	0.82
187.0483398	1.22
189.1291199	0.21
193.1977692	0.44
194.9650269	0.11
203.0818329	0.43
205.0828857	1.29
206.0619507	0.43
210.9119263	0.19
221.0802307	5.29
224.0453949	0.10
225.1242828	0.21
240.0391846	14.95
241.1854401	0.12
241.8719177	0.71
242.9975739	0.59
244.1007080	0.81
249.9753113	0.14
257.0670166	0.19
258.9777832	7.71
259.8449097	0.23
267.0729370	77.79
267.9488220	0.47
269.6589050	0.18
270.2869263	0.18
271.2256775	0.07
274.4865417	0.95
275.1072388	3.96
283.0449524	0.18
285.0140991	100.00
291.0133057	1.73
301.0009155	0.39
306.1535034	0.56
331.2142334	0.20
355.2966919	0.25
359.9434204	0.15
364.1296692	0.19
365.0350342	0.15
383.1408386	6.04
387.2211609	0.71
416.7952576	0.10
418.3653259	0.12
419.2641907	0.62
445.2709656	0.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	704.3284
Annotation	Unknow
Peak:m/z	Relative Intensity
203.0846252	0.39
204.9755707	0.47
207.0739899	0.08
212.8392944	0.12
213.4621277	0.09
231.0792084	0.63
239.0449371	0.49
244.2698364	0.27
248.0834961	1.85
249.2368469	0.38
258.1931152	0.21
282.1821289	0.17
297.5313721	0.62
299.3517761	1.21
300.5570374	1.04
302.3577881	0.33
306.1833496	0.12
317.0513306	1.54
318.1235962	0.74
319.0957031	0.19
323.0941772	0.12
324.2963257	0.23
325.2302246	0.18
335.1475220	12.12
336.3120117	3.33
338.0819092	0.12
340.2259216	0.12
341.9091797	0.41
368.2498169	0.38
389.4329224	1.39
396.0836182	0.61
397.2961426	0.54
407.1918335	4.77
408.3400879	1.94
409.2706299	0.25
413.6028442	0.24
418.5855103	0.20
420.2240601	0.47
422.9692383	0.16
424.4604492	1.10
425.2852173	0.34
441.2283936	3.16
442.3405151	2.18
443.4319458	0.42
444.4455566	0.10
448.5635376	0.11
455.3466187	0.29
456.5791016	0.35
464.0441284	0.82
466.2947388	0.84
472.7897949	0.29
476.4675903	0.65
478.0543213	0.20
482.0927734	4.83
483.2600098	3.07
484.1149292	1.18
488.1019897	0.20
492.1110840	0.72
493.1408081	0.39
494.1835938	0.20
495.1453857	0.78
499.2052612	0.47
500.4902344	0.09
503.6688232	1.02
504.4696045	1.23
505.2314453	0.75
507.1070557	0.24
514.9771729	0.37
515.8146362	1.13
520.3921509	1.51
521.3958130	3.76
522.3589478	4.28
523.3859253	2.37
524.2981567	1.44
526.3922119	0.55
528.3142700	1.14
528.9942627	1.37
536.4868164	0.39
537.6987915	5.70
538.6876831	3.75
539.3170166	20.34
540.2850952	11.49
541.3562622	2.55
550.1823120	0.18
555.1812744	0.15
558.5129395	0.85
563.5201416	0.66
564.4819336	0.92
565.1899414	0.50
566.4741821	1.98
567.5304565	1.08
568.3735962	0.40
571.6115112	0.30
572.7599487	0.89
573.4012451	0.37
574.5721436	0.70
581.7323608	1.31
584.8804321	0.32
590.0462036	0.41
591.4214478	2.95
592.6295776	2.54
593.6015015	0.09
595.0713501	2.15
597.6649780	0.19
604.0874023	0.20
609.3400879	10.75
610.2788086	10.54
611.4710693	3.15
613.4728394	0.45
621.0816040	0.56
622.3450317	0.38
623.1851196	0.49
625.7261353	1.58
629.8221436	11.75
630.4877319	3.55
631.3309326	1.07
633.3670044	1.81
634.4826660	0.52
635.4576416	1.41
636.2259521	1.12
638.9460449	48.78
639.9005737	5.63
642.9590454	0.63
645.1887817	1.23
646.0454712	0.20
647.6892700	0.27
648.3582153	0.49
650.1095581	0.18
650.7114868	0.24
652.3266602	20.54
653.3830566	19.87
654.4019165	4.76
655.7252197	0.17
659.3223877	0.49
664.9983521	0.18
666.5648804	0.27
667.3842163	0.58
668.2362061	0.66
669.5723267	0.31
673.8632202	2.33
674.8581543	1.13
678.6528931	3.58
682.7910767	2.75
683.6983032	0.10
687.2567749	35.31
688.2318115	8.63
689.1093140	0.45
694.5471802	0.23
696.0197144	100.00
697.1465454	7.49
698.3233643	0.42
698.9783325	0.64
700.0466919	0.41
701.4161987	0.48
707.8186035	0.16
720.7999878	0.98
721.4316406	0.29
722.5504761	0.91
724.3280029	0.80
728.5197144	0.25
729.4065552	0.86
738.4741821	6.72
739.5125122	10.39
740.2766724	2.57
741.3088989	0.76
753.8944702	0.23
756.4038696	13.13
757.4901733	20.44
758.4630737	2.61
759.6200562	1.17
764.6828003	0.33
780.6761475	0.22
782.3035278	1.42
783.4313354	0.84
784.5115967	0.13
799.3169556	8.33
800.3952637	11.36
801.3499146	3.55
808.2451782	0.32
812.2800903	0.10
817.3964233	0.59
823.4411621	0.20
825.8051147	1.61
826.5900879	0.22
834.5357666	0.22
836.5296021	0.57
837.6754761	0.33
842.3728027	1.01
843.7390747	0.21
851.6084595	5.87
852.6099243	9.38
853.4845581	1.54
854.4104614	0.26
869.5070190	28.87
870.4577637	43.86
871.4279175	11.86
872.3784790	3.11
873.1063843	0.08
885.7832031	0.30
891.6865845	0.25
901.4989624	0.29
908.4802246	0.25
909.6869507	2.29
910.4946899	0.85
922.8755493	0.35
924.4137573	0.47
926.5258789	5.51
927.6144409	13.60
928.6216431	3.53
929.8676758	0.14
942.0335083	0.25
950.3414917	1.49
951.7497559	0.44
967.5117188	3.92
968.4915161	12.49
969.6436157	2.06
970.3469849	0.13
973.5134277	0.45
978.6250610	0.21
996.3591919	0.11
1005.0012210	0.33
1005.9738160	0.35
1038.6934810	0.87
1042.4460450	0.67
1046.3566890	0.36
1047.7075200	0.30
1048.8807370	0.57
1050.6704100	0.98
1052.7972410	0.56
1053.6409910	0.24
1055.4377440	0.89
1056.5764160	5.46
1057.5104980	1.53
1058.4860840	1.11
1059.6466060	0.27
1068.5927730	0.75
1069.5446780	2.54
1070.6010740	0.33
1073.8264160	18.01
1074.6560060	48.07
1075.6982420	15.45
1076.7476810	2.65
1113.4840090	0.29
1130.5784910	0.13
1133.6699220	0.17
1143.6489260	3.34
1144.8110350	1.74
1158.8150630	0.45
1160.8776860	2.31
1161.7917480	8.49
1162.7434080	3.81
1163.6232910	1.11
1164.6707760	0.15
1187.5351560	0.40
1189.5158690	0.70
1197.2589110	0.14
1206.3243410	2.14
1207.6340330	1.62
1208.3031010	0.66
1225.5484620	0.17
1258.8143310	0.67
1276.5914310	5.54
1277.6583250	1.19
1294.1073000	0.46
1340.1976320	0.25
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
111.0529709	0.15
112.8320770	0.25
119.1893768	0.03
120.1249084	0.04
121.0753632	0.03
129.0214844	0.04
142.7431030	0.07
151.4680481	0.07
153.0011902	16.94
161.0617676	0.28
165.1106873	0.07
167.2182770	0.12
177.2631836	0.14
179.1588745	0.23
187.1997986	0.09
195.1703186	0.32
197.0807953	100.00
211.1974182	0.10
217.1908264	0.07
224.8860779	0.13
228.0783081	0.05
232.7207947	0.04
238.9889221	0.33
251.0464172	0.06
254.8254395	0.03
269.0057373	0.08
271.1029663	0.03
297.2489929	0.04
299.1901245	1.03
313.1424866	0.08
314.4169006	0.47
315.3160400	0.58
321.3288879	0.06
323.1872559	0.08
327.5581055	0.03
331.6430664	0.01
339.2218628	0.02
341.0820923	0.73
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	617.2617
Annotation	APC
Peak:m/z	Relative Intensity
223.1315155	0.08
225.2518463	0.06
239.2302551	0.02
241.2250061	0.06
255.2006531	0.03
265.2871399	0.03
294.1432495	0.04
301.9738159	0.03
318.3006592	0.02
325.3324585	0.05
329.1379395	0.18
343.5983276	0.04
345.1623535	0.03
373.2714233	0.05
386.8147583	0.09
389.3217163	0.14
391.1808472	0.13
394.6429443	0.05
409.4590454	0.13
410.5265503	0.03
442.7843018	0.10
450.3331909	0.38
451.5097046	0.19
456.0513306	0.08
472.5546875	0.16
474.2230225	0.11
480.8884277	0.12
487.5223389	0.04
489.2070312	0.08
501.4389038	0.14
505.1610107	0.03
519.9226685	0.03
528.7260742	0.02
529.5657959	0.05
531.3691406	0.27
532.3895264	0.04
534.2149048	0.09
543.4750977	0.05
545.0825195	0.12
555.5612793	0.23
556.6775513	0.21
563.4490967	0.06
569.4125366	0.03
570.3634644	0.11
573.3618774	100.00
574.3761597	51.17
580.2337036	0.04
581.7854614	0.13
587.4999390	0.10
595.4359131	0.09
599.1837769	1.28
600.2142944	0.94
600.8502808	0.06
604.1272583	0.05
608.8985596	0.02
620.1538086	0.06
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
157.0637817	0.09
158.9428711	2.57
159.9900818	0.68
160.9882202	0.86
162.0230408	0.03
199.0429993	0.28
200.0059814	0.23
200.8956909	0.55
202.1421204	0.03
216.9070892	0.09
218.2097473	0.04
219.1061249	0.15
229.1090393	0.44
230.2801208	0.32
230.9647675	0.20
231.9185181	0.06
244.9927063	0.03
273.0586853	31.53
274.0696411	18.13
275.0146790	38.86
276.0767517	6.21
291.2125549	0.01
346.0849304	0.05
387.0584412	31.68
388.2380676	38.48
388.9873352	100.00
389.9438477	30.18
413.8639221	0.09
428.9899597	0.10
442.0522156	0.02
456.8418579	0.03
458.0342407	0.13
458.8907471	0.33
460.1136780	0.03
484.7877808	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	382.1427
Annotation	Unknow
Peak:m/z	Relative Intensity
133.0210266	0.25
135.2048645	0.46
141.2137451	0.23
159.0116272	0.12
185.0227661	0.11
197.9646912	0.22
201.0772095	0.28
205.9871216	0.19
211.4716187	0.18
249.0946045	0.14
262.9881287	0.15
265.0758057	100.00
265.9814758	0.89
291.4291687	0.13
293.0766296	0.75
299.7894287	0.13
304.7217407	0.61
306.8715210	0.36
323.3286133	0.21
324.2918396	0.22
333.0397949	0.14
335.2533569	0.32
340.9495239	0.18
343.2837830	0.11
345.8410950	0.48
346.4910889	0.50
347.3110657	0.08
361.6791992	0.11
363.3257751	7.94
364.3149414	3.24
365.3905334	0.12
373.1419373	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	629.1713
Annotation	Unknow
Peak:m/z	Relative Intensity
180.7382660	0.08
182.8810272	0.11
188.9140930	0.59
202.6875610	0.06
223.1538239	0.11
224.7219238	0.08
233.0700836	0.10
237.0398102	0.05
241.0497437	0.91
251.0353394	0.22
256.1176758	0.09
256.7742615	0.08
257.5301514	0.15
259.0607300	2.78
267.0256348	0.09
268.9570007	0.61
275.4539185	0.61
277.1224365	0.20
284.1971436	0.19
284.8678284	0.14
287.0053711	3.49
293.2282104	0.24
298.1427612	0.23
301.2537231	0.11
302.9948730	0.45
305.0230103	8.55
306.0651245	0.29
307.2122803	6.22
308.0406189	0.06
315.2075806	0.04
321.5020142	0.15
322.9061279	4.44
323.5068054	0.03
324.3515015	0.07
332.8649902	0.40
334.9916382	0.09
337.2533569	0.08
338.3441772	0.16
340.4073486	0.17
341.0303955	0.04
350.9681396	0.33
353.0671387	0.11
355.2257080	0.96
358.8309326	0.26
379.3316040	0.18
389.0242310	0.20
396.4716797	0.28
415.0495605	1.18
419.0786133	0.12
425.1292114	0.09
427.1802979	0.10
432.3001709	0.15
433.1982422	0.26
433.9532471	0.50
440.3673096	0.15
445.1707764	0.25
450.5393677	0.47
451.1989746	0.18
459.1038208	2.05
459.8347778	0.07
460.9541626	0.57
462.5729980	0.16
466.6001587	0.12
468.2283325	0.73
475.1083984	1.01
477.6590576	0.04
479.0116577	3.29
484.2360840	9.80
485.2935181	0.07
489.8181152	0.31
491.0758667	0.36
492.9141235	0.12
497.0084229	0.05
500.1641235	0.25
510.6319580	0.16
513.0447998	0.17
538.2970581	0.12
547.1478882	0.22
555.8147583	0.46
562.2693481	0.12
564.7489014	0.09
568.1432495	0.19
573.0070190	0.06
580.2061157	0.07
590.1211548	0.06
595.4612427	0.97
602.2050781	0.10
608.3634644	0.68
609.3958130	0.26
611.2931519	1.14
613.1840210	100.00
614.2400513	0.76
620.2694092	1.32
676.4004517	0.23
679.3616333	0.11
723.2604370	0.11
789.1691284	0.18
793.4009399	0.20
806.9631958	0.13
813.1234741	0.09
859.4735718	0.20
930.9446411	0.06
935.1954956	2.24
1081.3835450	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	517.1631
Annotation	Unknow
Peak:m/z	Relative Intensity
157.2669525	0.06
157.9712982	0.57
175.0681915	100.00
337.1369019	0.38
474.1456299	1.74
499.1054688	0.08
500.3078003	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	883.01
Annotation	Unknow
Peak:m/z	Relative Intensity
258.8444214	0.15
290.0522461	0.12
291.0955505	0.04
342.4176636	0.36
358.1241455	6.37
407.2108765	0.28
422.0918579	100.00
423.4573975	0.03
470.9617310	0.08
475.0895996	0.07
625.4495850	0.04
649.5166626	0.04
657.3142700	0.07
696.1918945	0.10
697.2801514	0.12
705.4503174	0.05
721.5601196	0.17
728.9699097	0.05
746.0629272	0.13
747.0455322	0.06
749.8273926	0.08
751.3425293	0.12
785.4833374	0.04
807.2905273	0.04
817.6516724	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	154.0622
Annotation	L-Histidine
Peak:m/z	Relative Intensity
71.9285431	3.66
81.0533905	0.56
93.0215454	8.83
93.9972382	0.12
108.0197754	4.54
108.9207306	10.45
109.9604187	9.75
117.9949646	4.04
126.9966888	0.27
135.9482422	87.66
136.9862823	100.00
154.0421600	0.46
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
199.0698853	0.06
245.0246887	0.14
273.0367432	0.55
289.9882202	0.04
313.3534546	0.12
337.5258789	0.04
356.6469116	0.03
358.6918335	0.26
359.3465576	0.21
386.8718262	0.22
388.9086914	0.04
403.1371460	0.07
404.1563110	0.20
424.2949829	0.16
427.0957642	5.51
429.2464600	0.03
429.9682617	0.12
430.6331787	0.11
443.1605225	0.16
469.7526245	0.04
471.1464844	0.18
472.8032837	3.75
473.4345093	0.06
482.9864502	0.15
485.0332642	0.03
503.2158813	0.11
512.0645142	0.19
513.0178223	0.29
527.8375244	0.04
528.9695435	0.06
539.4594116	0.42
540.8478394	100.00
541.7245483	0.37
542.5037842	0.28
543.1416016	0.04
558.1213989	0.14
558.9967651	0.11
568.9435425	0.19
587.1559448	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	224.0564
Annotation	4-Amino-4-deoxychorismate
Peak:m/z	Relative Intensity
73.8800049	0.04
119.1286621	2.30
121.0456085	0.04
136.0688324	0.29
137.0208282	0.27
150.0431366	2.14
151.0919647	0.41
156.0446167	0.06
162.9561615	100.00
179.0224762	1.45
180.0095367	19.17
206.1536407	1.90
207.0366516	1.50
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	431.1192
Annotation	Griselinoside
Peak:m/z	Relative Intensity
124.9889603	0.18
136.9042816	100.00
137.9767303	6.77
148.8043823	0.08
191.1815948	0.11
209.0492859	0.47
210.0702820	0.04
213.9330750	0.05
233.2388000	0.03
269.1588135	3.27
270.2268982	0.64
272.0295715	0.04
286.3605957	0.08
293.0264893	0.80
294.0077209	0.14
304.7831726	0.15
316.1068726	0.06
323.1391602	0.12
336.3684082	0.04
344.1790771	0.25
373.7614136	0.06
377.3138428	0.03
385.1750793	0.10
386.1015930	0.21
387.2507019	0.18
388.1524963	0.22
401.3802795	0.28
411.1109924	0.30
412.2684631	0.06
413.1125793	0.15
414.1034851	0.21
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	635.82
Annotation	Unknow
Peak:m/z	Relative Intensity
234.8719788	0.21
299.8895874	0.39
315.9155884	0.89
336.7930908	0.22
353.9935913	0.26
367.0087280	0.39
383.2863159	0.23
384.0691528	0.69
385.1629639	0.20
409.4893799	0.09
421.7340698	1.14
423.1641846	0.71
424.1386719	0.16
437.9375000	1.22
440.0926514	0.50
443.0964966	0.16
444.1583252	0.19
445.4647217	0.25
451.1348267	0.33
464.8681641	0.08
467.8958130	6.33
472.6492310	0.78
483.2348633	0.23
483.9993896	1.50
503.0091553	0.91
504.1602783	0.33
505.7938843	6.09
517.2429199	0.40
521.9771118	0.15
549.8391724	0.76
551.7191162	30.12
552.4418945	0.09
567.1071167	0.23
567.7670288	0.58
589.2185669	12.20
589.8234863	100.00
591.7937622	0.36
592.7594604	0.17
614.6908569	0.13
619.6034546	0.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	253.0851
Annotation	7-Methoxyflavone
Peak:m/z	Relative Intensity
76.93161011	0.03
91.09069824	0.03
95.06338501	0.05
102.9368439	0.20
103.9798584	0.03
104.8671722	0.14
107.2179718	0.13
108.9925232	0.17
118.8495941	0.04
123.2785034	0.10
128.9990997	1.18
130.0675354	0.26
132.7989349	0.03
141.0425415	0.05
145.8897552	0.12
150.995163	11.73
152.0576935	1.81
153.0487976	0.30
154.2420044	0.13
155.0175323	0.22
157.3941193	0.05
165.1397705	0.03
167.0731201	0.43
168.1414642	0.06
169.0187836	0.27
169.8392487	0.05
178.03685	0.05
179.1532593	0.15
179.9561615	0.16
181.0376282	0.05
181.9924316	0.05
182.999649	0.05
185.1598816	0.32
185.9767151	0.12
189.139328	0.04
191.1365509	0.10
194.313736	0.02
196.9665375	0.65
198.1881866	0.32
209.1038666	0.02
210.3147736	0.10
211.1009827	0.13
211.9040833	0.12
217.5053406	0.07
225.1131744	1.42
226.1293793	0.57
236.3558197	0.07
238.077774	2.38
239.1213989	0.72
240.152771	0.20
251.2058563	0.12
253.0873871	100.00
254.186264	3.07
255.0701447	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	518.1788
Annotation	Unknow
Peak:m/z	Relative Intensity
151.1332397	0.33
161.9136505	0.92
166.8822327	0.68
179.0305023	3.89
181.0633545	0.91
208.9340210	0.15
211.1011047	9.39
233.0580292	3.17
253.2174530	0.15
272.0350342	0.14
285.8684692	0.51
290.0766907	1.11
291.3938599	0.29
305.8999634	0.13
308.1231079	100.00
324.4755249	0.45
337.9823608	0.26
355.5062256	0.23
357.0993042	1.71
385.1713257	2.66
385.8459473	0.13
388.9265747	2.44
401.3041992	0.64
412.2235107	0.84
443.0130005	0.26
456.3894043	0.80
465.3781128	0.30
471.3678589	0.47
474.1952515	0.38
474.8739624	0.82
482.6192017	0.15
490.1936646	0.59
494.7595825	0.30
500.3159180	1.06
501.4534302	0.23
508.6586304	1.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	362.997
Annotation	Unknow
Peak:m/z	Relative Intensity
111.0126648	4.82
128.9429321	0.31
132.9992218	1.96
134.1085968	0.03
135.1887207	0.06
155.9200745	0.09
163.4021912	0.03
164.0286865	0.08
171.2424774	0.04
172.9132080	1.36
176.0928955	0.06
177.0555115	0.04
179.0869446	0.08
186.9742126	0.10
188.9194946	0.07
190.9821472	100.00
193.1294556	0.05
200.2448883	0.16
204.2250671	0.10
210.9587097	0.32
212.0957336	0.11
213.1391296	0.06
224.0678406	0.10
227.3649597	0.20
228.3452454	0.03
230.9210510	0.20
233.1289673	0.30
241.1919861	0.06
246.9659424	0.03
250.6371155	0.11
253.0516357	0.04
254.4803162	0.04
255.7949219	0.25
257.2469482	0.02
258.3670654	0.30
259.0370789	3.13
260.9951477	0.10
274.1324463	0.21
275.1062317	0.16
279.1008606	0.02
283.2661743	0.04
296.9741211	0.04
300.7117615	0.10
302.0346069	0.04
303.0321655	1.65
306.1123047	0.18
315.8101501	0.10
317.0074463	0.15
317.9837646	0.59
319.0867615	0.47
326.1791992	0.05
327.0993347	0.10
332.9851685	0.04
344.4465637	0.67
345.1759949	1.34
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	531.1089
Annotation	Unknow
Peak:m/z	Relative Intensity
161.9584656	0.18
168.8400269	0.05
197.0231628	0.51
197.8067780	0.05
207.1450195	0.93
213.2007141	0.07
225.1957245	0.09
245.0133209	0.06
246.0338745	0.04
249.3297424	0.11
281.1060181	0.04
282.2087708	0.08
283.2793274	0.31
284.3728638	0.11
286.2836304	1.83
287.1515503	0.33
289.4432983	0.25
305.2916870	0.05
307.9321899	0.08
309.3746948	0.07
315.0209351	0.13
326.4121094	0.12
341.9935303	0.07
351.1361084	0.16
360.4398804	0.18
369.1912231	1.93
382.2405396	0.27
384.1597290	0.05
388.3811035	0.04
391.0974121	0.13
397.8284302	0.08
401.3175659	0.41
401.9340820	0.05
410.0929565	100.00
415.2327271	0.11
425.3696289	0.17
441.3566284	0.41
447.9953003	0.36
449.2859497	0.09
454.7386475	0.13
455.7765503	0.06
467.0809326	0.36
468.9229126	0.13
469.6743774	0.21
475.1416016	0.04
484.2993164	0.15
486.9025269	0.31
490.1145020	0.10
495.2775269	0.04
498.7380981	0.12
502.2875366	0.16
504.3814087	0.07
507.3148804	0.22
508.7096558	0.20
509.5714722	0.07
511.6206055	0.65
512.9721680	0.62
513.6838379	0.23
518.3666992	0.18
520.2033081	0.40
522.4871826	0.08
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
129.0693817	0.15
174.7848969	0.35
179.2423401	0.07
202.9958649	0.10
210.1098785	0.18
214.8478394	0.16
227.1576080	0.33
242.7565918	0.05
270.8972778	1.41
274.3374329	0.47
276.0719604	0.56
276.8314819	0.09
287.1131897	0.36
292.3892212	0.33
305.0151978	2.91
307.2964172	0.83
309.2350769	0.40
314.9709473	0.63
319.6255798	0.40
322.3454285	0.19
324.3853760	0.24
331.1156006	0.20
333.0611572	6.44
335.1446533	1.40
337.1430664	0.10
339.1088867	0.22
340.9266968	0.13
348.9012756	0.83
358.9306335	0.12
360.8355103	0.48
365.2043457	0.45
376.9632263	3.47
379.1748352	0.29
394.0193787	8.51
395.0645447	12.79
403.0324707	9.84
421.0467834	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	495.0447
Annotation	Unknow
Peak:m/z	Relative Intensity
152.1434784	0.10
152.9379883	0.07
161.0583496	0.03
171.3063507	0.02
182.0885925	0.09
184.9337158	0.09
187.1210632	0.08
189.3168335	0.05
190.0275421	0.03
192.0773926	0.09
193.5715790	0.10
202.0575714	0.13
203.9247131	0.10
211.0446320	0.05
231.0270538	0.06
240.9750671	0.08
244.2996979	0.04
248.2690735	0.10
249.2485962	0.05
254.2756348	0.06
254.9538574	0.11
272.2238464	0.15
273.1988525	0.06
274.0555115	0.04
282.9615784	0.08
288.1970215	0.24
306.2019958	7.43
307.3018188	1.28
315.2497253	0.11
327.2159424	0.11
332.5833740	0.15
333.3881226	0.03
345.1769409	0.13
346.4223328	0.03
348.0122070	0.03
349.2180176	0.04
351.0676880	0.07
364.3303833	0.14
365.3617554	0.06
369.5223083	0.02
370.2348328	0.12
371.2973022	0.05
372.2608032	0.09
374.3059082	0.08
377.2246094	0.04
391.2673950	0.16
395.4110413	0.09
396.2254944	0.03
397.9275818	0.02
399.2384949	0.03
405.2169495	0.24
406.4764099	0.04
407.3847046	0.02
409.1387329	58.82
409.7833862	0.23
410.4739075	0.03
414.4588318	0.20
415.5986938	0.09
419.1648254	2.36
422.4208374	0.03
430.1817322	0.02
431.2872620	0.30
432.5616150	0.03
433.5076904	0.04
434.6124573	0.04
435.5092468	0.14
447.3833313	0.04
449.1301270	0.95
451.0951843	100.00
451.9421692	0.05
455.1397400	0.06
458.6983337	0.21
460.3981018	0.04
463.1359863	0.83
464.5550842	0.07
467.5012817	0.02
475.2499695	0.16
477.1369324	4.90
484.6460876	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	359.1786
Annotation	Unknow
Peak:m/z	Relative Intensity
112.6413193	0.04
139.8498993	0.30
142.9820251	0.04
145.1415100	13.99
158.9079285	0.72
167.0801392	0.15
185.1522217	0.14
187.8039703	0.07
193.9356842	0.12
194.8616028	0.02
196.1413879	0.30
211.5601044	0.15
213.1417847	2.01
214.0145874	0.08
223.1599121	1.04
227.0208740	0.18
231.0893860	0.33
233.1708679	0.03
239.0622253	0.20
240.1786804	6.33
241.0811768	0.22
245.1135864	0.10
250.1854858	0.04
253.2226868	0.30
254.2247620	0.14
258.2221069	0.84
261.1683044	0.02
262.1176758	0.27
262.9967346	0.41
266.9641113	0.11
268.8773193	0.27
275.3179016	0.04
277.2816772	0.07
279.1142578	2.76
280.2460327	0.90
281.1144104	0.06
284.5208740	0.09
285.4315796	0.03
293.1379700	0.02
294.2118530	2.19
296.1636963	10.50
297.2323608	0.62
298.4451599	0.22
299.1444702	0.16
300.2298279	0.10
301.3904724	0.18
313.2277222	100.00
314.2844543	2.87
315.1620178	0.04
323.3419800	0.06
329.6328125	0.04
331.1847534	25.34
332.1439209	0.45
339.1319580	0.20
340.7338257	0.36
341.4072571	0.25
343.0527039	0.20
343.9458313	0.03
356.5048523	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	474.1719
Annotation	Folinic acid
Peak:m/z	Relative Intensity
147.9890442	0.85
188.3631287	0.84
232.0915527	1.14
247.2294464	0.37
260.1873474	1.55
262.1967773	1.06
281.9766541	0.73
298.4520874	0.50
301.1599731	1.23
327.1074829	100.00
345.2542114	37.96
385.6031799	0.59
401.289856	1.22
405.394989	1.11
428.3162842	2.32
428.9786682	0.35
430.5489807	5.43
439.5099792	0.91
455.6786194	3.26
456.3093262	24.12
457.0953979	0.50
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	665.1807
Annotation	Unknow
Peak:m/z	Relative Intensity
192.1540527	0.04
259.0411682	0.03
273.8942261	0.02
275.1378174	0.05
285.8001099	0.06
293.3197632	0.04
317.0126038	0.02
318.3469849	0.13
330.1032104	0.34
370.2422485	0.07
375.0241089	0.04
405.8429565	0.02
417.1170654	0.04
423.1658325	0.04
429.4022217	0.04
431.1681519	0.40
432.0618286	0.08
444.4463501	0.13
459.3369751	0.65
461.1326904	100.00
462.2654419	1.15
463.1945801	0.45
489.1265259	0.04
501.2077637	0.03
503.1508179	0.04
514.3255615	0.11
533.5567627	0.01
536.1408081	0.03
537.2971802	0.02
543.4014282	0.08
555.3076782	0.05
578.2754517	0.05
581.9431763	0.06
591.7289429	0.02
602.2237549	0.16
603.1489258	0.06
617.7322388	0.05
618.3723755	0.03
619.1564941	0.07
619.9717407	0.28
621.3705444	0.06
633.4531860	0.03
635.1303101	0.09
647.3755493	0.24
656.4465942	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	970.1782
Annotation	Unknow
Peak:m/z	Relative Intensity
288.0940552	0.09
306.0493164	0.79
353.4037476	0.07
358.1151733	100.00
359.8019714	0.09
482.3049927	0.68
509.3092041	0.06
547.3224487	0.19
593.2113647	0.20
611.1970825	7.62
626.2693481	0.05
662.3295288	0.09
666.1514282	0.06
676.1449585	0.09
690.8668823	0.38
691.4762573	0.03
738.7183838	0.16
739.5701904	0.05
774.2301025	0.08
779.2450562	0.05
840.6791382	0.30
841.3026123	0.35
854.5999146	0.09
865.6440430	0.07
906.4729614	0.08
951.8007202	1.35
952.4641724	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	626.69
Annotation	Unknow
Peak:m/z	Relative Intensity
206.8479309	1.10
277.3444824	0.09
290.6307373	0.80
343.9003296	0.27
374.6543579	0.94
415.0156860	0.55
458.5682983	14.43
466.8812256	0.18
491.3499146	0.21
500.4634399	0.29
527.7368774	0.09
540.7296143	0.18
542.5682373	100.00
579.6853027	1.27
580.7524414	0.86
584.4270020	0.50
602.9605103	0.60
603.7190552	0.23
605.8870239	0.15
607.7045898	0.29
609.4256592	0.46
626.4584351	0.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	972.1874
Annotation	Unknow
Peak:m/z	Relative Intensity
288.2444458	0.11
298.3087769	0.04
322.2635498	0.27
336.9816895	0.14
355.1532898	8.30
362.8112183	0.02
374.1960754	0.08
380.9666138	0.06
391.0259399	0.08
409.2225952	0.99
466.1604004	1.58
484.1416016	20.39
484.8035889	0.28
538.3355103	0.69
577.1769409	0.10
595.2352905	3.56
613.1655884	100.00
613.8496704	0.17
692.8748169	0.23
775.1655884	0.36
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	311.1691
Annotation	5S-HETE-d8
Peak:m/z	Relative Intensity
96.85306549	0.58
98.84950256	1.01
113.0265045	0.72
119.0874329	0.52
128.1402283	0.36
133.1915894	0.40
141.1493835	0.28
155.0219727	0.65
155.9076233	0.38
165.3678436	0.49
170.0500641	4.41
183.0043335	100.00
184.0233002	20.49
185.1347656	0.77
196.9998779	37.96
198.0381012	7.57
199.280426	0.45
205.2094421	0.17
208.2571106	0.46
210.8891296	1.76
212.0463867	6.26
212.8877869	0.60
217.0906677	0.64
221.3811646	0.49
223.5446167	0.33
225.0533752	5.26
226.0195618	3.00
227.023407	2.14
228.7972412	0.17
235.2182312	0.66
239.1292114	7.27
240.3274841	1.10
242.0661316	0.43
245.3522034	1.12
247.2646179	9.16
248.3893127	0.68
249.3911438	4.46
251.358429	0.65
253.3225098	1.43
254.1531372	0.98
255.4963684	1.27
256.1581726	0.43
263.1188965	1.31
265.3598938	0.95
267.2205505	8.26
268.3335571	0.22
269.3353271	0.31
271.0411987	0.59
275.2447815	0.66
281.3892517	0.40
283.11203	1.96
284.1424561	0.37
291.1888733	0.49
292.4659119	0.56
293.3109741	12.59
294.165741	0.38
294.9358521	1.47
311.2898254	22.47
312.4439697	4.55
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	455.113
Annotation	Mulberrofuran R
Peak:m/z	Relative Intensity
143.9751434	0.37
145.8749542	0.40
170.0578766	0.04
172.0193787	0.62
179.0300903	0.05
186.2461243	0.05
187.8806458	0.03
188.8085327	0.03
189.9580994	0.16
197.1855774	0.19
213.0715332	0.06
215.0647888	22.10
225.1627045	0.07
226.7926636	0.04
228.2676086	0.05
230.9679260	0.49
241.1970825	0.84
242.1481171	0.05
243.1644897	0.04
249.1861267	0.13
251.3911438	0.08
258.1721191	0.04
259.1838074	2.71
275.2921448	0.27
285.5453186	0.07
289.0516968	0.04
293.1220093	4.32
301.1966553	0.42
311.1931763	0.04
318.2129517	0.03
334.1794739	3.07
339.1833801	0.54
340.4075317	0.17
344.2023315	0.11
352.2091064	0.71
353.2046509	0.05
356.2051697	0.03
357.6066895	0.16
367.4851685	0.12
368.3528442	0.18
369.1599121	0.20
375.4017334	0.06
377.2703552	28.94
381.1085205	0.03
386.0975037	0.05
391.4729309	0.06
392.8097534	0.04
393.6854248	0.05
401.8256226	0.04
403.2392883	0.67
408.2521362	0.11
409.2875061	0.37
410.2389832	0.18
410.8567200	0.02
411.5133972	0.05
417.9516907	0.05
419.2488098	0.23
421.1870728	100.00
425.2356873	0.05
434.9283142	0.03
437.0635681	0.24
440.0740662	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	290.85
Annotation	gamma-Pentachlorocyclohexene
Peak:m/z	Relative Intensity
122.8881378	1.38
130.0115051	0.02
206.8142395	100.00
207.5930176	0.01
272.8214722	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	457.1385
Annotation	3-Hydroxynevirapine glucuronide
Peak:m/z	Relative Intensity
202.3188477	0.31
215.0602417	0.10
220.7826538	0.04
235.1797180	0.06
244.2785950	0.10
259.2816467	0.06
273.2713623	0.05
275.2435608	0.08
279.4059448	0.08
287.5926514	0.18
289.0653687	0.08
290.9896545	0.19
321.4785767	0.10
328.1234436	0.06
329.7328491	0.27
331.2721863	0.05
341.3511047	0.18
353.5551758	0.19
359.4653320	0.04
360.1224365	0.16
367.5879211	0.33
371.2703247	56.89
372.2449646	12.28
373.2602844	0.10
374.1026001	0.09
376.2754822	0.11
379.5283508	0.12
383.1400452	0.08
384.3440552	0.05
385.1668396	0.16
388.5665283	0.05
391.4587097	0.04
394.0231018	0.07
395.0755615	0.12
397.4749451	0.11
399.0332336	0.06
400.0050049	0.05
409.7073059	0.13
413.1698608	100.00
414.2859802	21.08
415.5186157	0.29
416.2087402	0.10
417.3748779	0.14
420.1389465	0.79
421.2148438	0.36
422.1834412	1.37
423.5915222	0.11
429.3825989	0.17
439.2099304	3.66
440.3436279	1.61
441.2174988	0.32
448.6808167	0.91
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	502.2943
Annotation	LysoPE(0:0/20:3(8Z,11Z,14Z))
Peak:m/z	Relative Intensity
168.0060425	0.05
168.8182983	0.10
191.0892181	0.04
197.9769287	0.29
199.1322937	0.06
203.3237000	0.13
212.0184479	0.26
221.9504700	0.04
224.1040344	2.41
233.2699280	1.23
242.1882324	1.77
259.3246765	0.17
261.6824646	0.25
273.0560303	0.13
275.4638367	0.48
277.2342834	100.00
283.3323059	0.06
293.1554565	0.07
308.1278381	0.05
334.0614624	0.11
342.4728394	0.15
365.3602905	0.12
395.0068970	0.11
411.2158203	0.13
412.4464417	0.22
413.2066345	0.21
414.1553040	0.20
418.2618713	0.10
426.0124817	0.10
427.8399353	0.09
434.2927551	0.07
446.6862488	0.23
448.3550110	0.19
452.1250305	0.04
454.3419495	0.21
456.2719727	0.80
457.3805237	0.09
458.3240662	0.05
460.0472107	0.07
464.2581482	0.31
465.3157043	0.08
466.3383484	0.42
482.3287048	0.08
483.8576355	1.12
484.7552795	0.44
485.4623718	0.05
486.1560974	0.23
487.2186890	0.16
495.2559509	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	517.9
Annotation	Unknow
Peak:m/z	Relative Intensity
159.0276031	0.44
160.4140778	0.01
174.9743042	0.59
175.9625854	0.12
199.0238037	0.07
214.8015747	0.03
228.9977875	0.10
230.0310059	0.03
245.0309143	0.06
246.0664368	0.11
273.0180664	7.59
274.1017151	2.90
288.9961243	10.06
289.9465942	3.10
387.0150757	0.47
388.0914307	0.33
402.9725342	100.00
403.9535522	42.96
442.7376099	0.11
443.9837646	0.04
447.2086182	0.04
454.9533081	0.02
456.1153564	0.05
462.0286255	0.03
470.9053345	0.06
472.0105591	0.17
473.5648193	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	753.2244
Annotation	Sibiricose A4
Peak:m/z	Relative Intensity
215.1237030	0.04
216.9562836	0.22
221.1659546	0.03
223.1831970	3.57
228.1297760	0.03
230.0736389	0.19
231.1307068	0.17
232.0078125	0.43
236.0401154	0.02
239.3271637	0.02
245.1796875	0.37
246.0654449	0.31
247.0417786	2.40
248.1666260	0.03
250.8489227	0.05
258.0014954	0.08
259.1539307	0.15
259.9943848	0.03
261.1795044	0.48
263.0591431	0.21
265.2049561	0.55
272.1316833	0.15
274.1332703	0.31
274.9928589	0.03
276.1573181	0.02
277.1408691	0.50
279.2537842	0.03
281.2206116	0.04
287.2398071	0.37
289.1925659	8.00
292.3359985	0.03
295.0785828	0.12
301.2277222	0.15
305.0371094	0.28
306.8348083	0.11
307.6104126	0.06
323.2182617	0.14
331.1109619	0.52
349.2471313	0.27
351.1757202	0.05
357.4275818	0.02
367.0755615	0.20
376.4532471	0.04
385.1770630	0.42
411.3035889	0.03
413.2194214	0.02
427.2041626	0.36
429.2971802	0.04
439.1353760	0.06
457.2962646	0.26
467.4569702	0.03
469.3407593	0.15
487.2311401	0.58
493.3908081	0.10
494.9933472	0.04
499.3355103	0.04
511.3399048	0.27
513.4348145	0.03
514.5973511	0.13
515.4161377	0.48
516.8647461	0.01
518.2330933	0.04
529.2225342	100.00
529.9817505	0.38
547.0874023	0.45
557.6191406	0.04
564.5950317	0.12
573.3955078	0.03
604.2258911	0.04
613.3106689	0.02
630.5628052	0.03
631.1830444	0.03
637.7931519	0.04
649.1965942	0.02
651.5576782	0.06
654.5461426	0.09
666.2640381	0.11
667.1138916	0.17
674.4391479	0.13
686.7465210	0.02
691.4713745	0.12
693.2750244	0.14
701.5938721	0.07
703.1525269	0.06
708.6336060	0.14
709.2592163	0.23
710.4984741	0.02
716.3692017	0.03
721.1577759	0.03
722.5719604	0.08
734.7608643	0.45
735.4532471	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	489.2706
Annotation	9-Hydroxy-10-O-D-glucuronoside-12Z-octadecenoate
Peak:m/z	Relative Intensity
142.9767914	0.13
151.2028351	0.06
160.8400726	0.10
164.1346436	0.17
165.1517334	0.12
166.7928314	0.06
174.9204102	0.07
176.0709381	0.07
178.9598083	0.16
184.0221558	0.05
188.0942078	0.07
193.3462524	0.21
205.5019226	0.08
206.4187164	0.03
207.2208557	0.44
211.0943298	0.05
212.0392609	0.04
217.2944794	0.04
219.3908691	0.09
221.2700195	0.08
223.3664246	0.07
227.2399597	0.07
229.0459137	0.05
231.2748413	0.20
235.2030640	1.27
236.9943085	0.07
239.2489624	1.04
240.3421936	0.13
241.0391083	0.04
245.5516663	0.14
246.2637024	0.18
247.1369019	0.20
249.7218323	0.19
251.3136597	0.28
253.4306946	0.23
255.1235046	0.06
262.0222778	0.06
262.9498291	0.08
264.7075806	0.04
266.1689148	0.18
267.5009460	0.07
269.0430908	0.08
271.3947144	0.04
275.2715759	0.08
277.4962769	0.26
279.1930237	0.05
281.2011414	0.94
282.2225037	0.13
283.3056641	0.08
287.3581543	0.28
291.3991089	0.37
293.5449829	0.05
294.4379578	0.04
295.4418335	0.12
296.3004150	0.13
297.4127197	0.08
303.3847656	0.12
305.2260132	0.18
306.1924438	0.04
307.2609253	0.15
309.2542725	17.93
310.2592163	3.91
311.2255859	0.66
312.4232483	0.05
323.2997437	4.36
324.3664551	0.81
325.3418274	0.18
326.2059631	0.07
327.2639160	100.00
328.3158264	26.78
329.2342834	0.47
335.2905884	0.17
349.1434937	0.06
351.3152771	0.26
352.5135803	0.21
353.5169373	0.14
354.2732849	0.37
365.5529480	0.08
369.4448547	2.31
370.4086304	0.57
373.4019775	0.03
374.4805298	0.05
375.4698486	0.08
376.1748657	0.17
381.3116760	2.63
382.3627014	0.98
384.9820251	0.07
391.3513489	0.07
398.0777588	0.05
399.3250427	0.06
400.1976318	0.09
401.1366272	0.16
402.0863342	0.10
402.7981567	0.07
405.3736877	0.70
415.0014343	0.05
416.3844299	0.12
417.6745300	0.07
421.2760925	0.04
428.6344910	0.04
429.2711487	0.11
432.2280579	0.08
443.3825378	0.18
444.1358032	0.04
445.4169312	0.24
446.1990051	0.49
447.1565857	0.35
450.3446350	0.10
451.9178772	0.16
453.1958923	0.09
454.2161560	1.58
454.9923401	0.09
456.3716736	0.20
459.8770447	0.35
470.1797791	0.03
471.3818054	2.27
472.3347778	1.28
473.1523743	0.24
475.2337952	0.08
481.4053345	0.61
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	404.1544
Annotation	Perphenazine
Peak:m/z	Relative Intensity
132.9609375	0.04
144.8755035	0.04
162.1970978	0.12
175.0544739	0.78
177.0390320	0.11
179.9552460	2.15
207.0488892	19.93
221.1736603	0.03
225.0053864	100.00
231.1015015	0.06
236.4637146	0.06
239.8137512	0.04
241.2926941	1.02
241.9493408	15.31
257.2944031	0.03
267.2216797	0.06
272.9414062	0.10
273.9237061	0.04
280.1355286	0.11
285.4953003	0.04
288.1133423	0.25
288.9060669	0.09
292.8449707	0.13
299.7941589	0.03
307.2227783	0.02
309.0467529	0.05
313.1633911	0.03
315.0498962	0.09
318.1262207	0.03
322.9206543	0.28
325.1154480	0.16
328.5891113	0.04
330.1729736	0.03
332.1857910	0.04
337.2498169	0.13
341.1933594	0.05
343.3106079	0.03
348.3514404	0.04
349.3281250	0.02
351.1337891	0.19
355.5753784	0.04
358.1219177	0.11
359.2060852	0.02
365.9780579	0.08
368.3294373	0.12
368.9415588	0.22
371.6134338	0.07
385.3495789	0.18
386.3563538	1.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	465.0708
Annotation	Unknow
Peak:m/z	Relative Intensity
179.1375427	0.09
183.8709412	0.02
185.0826721	0.03
239.2618713	0.03
260.0155029	0.04
262.0933228	0.12
269.3292847	0.02
278.0167236	0.03
285.7850952	0.08
300.2420959	0.04
325.3775635	0.03
327.1406555	0.03
332.7538452	0.03
341.1826172	0.03
343.4500122	0.12
344.3451538	0.02
345.2991943	0.03
347.1557007	0.06
361.1648560	0.13
369.2790833	0.03
379.2153015	47.73
380.0050964	0.04
386.2382202	0.07
389.1033630	0.03
398.3078918	0.04
399.3320312	0.05
400.5920105	0.02
402.9301758	0.06
406.3574524	0.01
415.4036255	0.04
419.2319641	0.15
421.1090393	100.00
422.1927185	0.05
428.0304260	0.06
429.3717041	0.05
431.2195740	0.03
433.1180420	0.04
434.4207458	0.06
444.3393860	0.02
445.3855286	0.03
446.6455994	0.36
447.2587585	3.76
448.2833862	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	315.0719
Annotation	4-(beta-D-glucosyloxy)-3-hydroxy-benzoic acid
Peak:m/z	Relative Intensity
92.0522308	0.10
93.0593872	0.60
98.9018555	0.03
101.0472412	0.06
107.9242249	5.85
108.9226379	9.73
109.5236588	0.05
111.0281296	0.10
113.0867615	0.26
118.8892746	0.17
120.9138184	2.37
123.0039291	2.17
124.9280853	0.25
130.9755402	0.05
133.1175537	0.37
134.1216278	0.31
134.8785706	0.40
136.0368042	2.14
136.9742737	0.33
143.0339966	0.23
145.0134277	0.06
146.9622803	0.17
148.9862366	0.20
151.0956726	6.72
151.9399109	39.60
152.9532471	100.00
158.8766785	0.25
161.1334991	0.32
163.0472717	8.80
165.0125122	13.48
167.1971741	0.25
175.0686035	0.41
177.0972900	0.90
178.9906616	2.84
181.1053772	3.84
189.0871429	0.34
191.1520386	0.07
193.1302185	1.38
195.1085968	3.53
205.1067200	0.35
207.0109253	4.77
217.1264648	1.00
218.9232178	1.28
220.9876099	0.07
225.1589355	8.30
237.0351562	0.69
249.1614990	0.07
251.1618347	0.07
255.4620056	0.37
261.0774841	0.15
267.1583862	0.18
269.0899353	0.14
270.9851685	0.17
296.2053223	0.16
297.1392822	0.57
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	436.0409
Annotation	Glucoraphanin
Peak:m/z	Relative Intensity
128.8751526	0.02
138.8741302	0.12
145.0148315	0.10
163.0180359	0.22
174.8966980	0.15
176.0619812	0.16
177.0213013	0.33
178.0208130	0.98
179.0687866	0.05
194.0576172	0.44
195.0088654	0.07
198.8430634	0.23
199.8392334	0.03
209.7300110	0.03
225.1598663	0.04
226.0481720	0.03
227.0834961	0.48
241.0575562	0.06
243.0101013	0.20
246.9918213	0.09
247.8889771	0.05
258.0800781	0.62
259.1295166	3.21
259.9223938	0.03
272.0476074	0.07
272.9297180	0.04
274.9851685	0.97
291.0440369	1.46
306.1370850	0.04
307.1085205	0.10
318.0021667	0.04
320.1551819	0.04
338.1502686	0.04
340.2109985	0.16
356.2158813	0.72
372.1470337	100.00
373.2577209	0.09
391.1947937	0.16
417.9896545	0.04
421.2203064	1.49
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	451.2178
Annotation	Unknow
Peak:m/z	Relative Intensity
150.8973846	1.70
189.0510559	5.95
235.1243286	4.19
263.0484924	14.20
310.4676208	0.29
331.1635742	4.27
334.1475525	0.73
339.1429443	1.33
347.7729797	3.46
358.0461121	2.62
376.1744690	100.00
384.2277832	0.81
405.3847961	2.07
414.9725952	0.41
433.1647949	10.86
434.1573181	0.78
442.4542542	1.77
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	753.2245
Annotation	Sibiricose A4
Peak:m/z	Relative Intensity
223.1537476	2.94
232.2811279	0.08
245.4517059	0.04
247.1700439	1.23
248.1618958	0.15
259.9911499	0.15
261.0066833	0.20
265.2142944	0.72
275.2178040	0.22
277.4627991	0.07
289.0167847	1.22
293.0435791	0.08
295.1994629	0.41
305.2383423	0.24
312.9238586	0.20
323.1713562	0.11
331.1871338	0.35
337.3830566	0.61
339.8947449	0.08
343.3659668	0.17
349.3071289	1.59
367.2628174	0.64
391.3458252	0.16
395.5884399	0.18
404.1650391	0.07
404.9683228	0.23
427.4399414	0.53
444.3923340	0.10
450.8501587	0.06
469.1279297	0.43
487.2744141	0.23
511.3328857	0.36
514.3876953	0.25
515.2831421	0.29
529.2106323	100.00
529.8724976	0.18
547.2989502	0.41
553.6696167	0.26
565.3630981	0.43
572.5888672	0.26
573.6329956	0.12
591.5714111	0.30
592.2185669	0.07
595.3886719	0.12
615.4757080	0.07
631.5762939	0.33
632.5032959	0.21
644.6187134	0.12
647.5347290	0.18
657.3289795	0.12
665.3390503	0.12
674.3288574	0.45
675.7610474	0.25
686.4816895	0.12
690.3826904	0.15
693.4348755	0.26
704.0053101	0.08
707.2932739	0.09
708.6249390	0.56
709.4320679	0.34
710.2985840	0.17
715.4341431	0.25
717.4931030	0.07
721.3828125	0.25
735.2125244	1.17
736.9506226	0.21
745.7129517	0.49
746.8544312	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	358.0269
Annotation	Sinigrin
Peak:m/z	Relative Intensity
105.9304657	2.04
115.9660873	3.16
118.8994141	2.18
128.8405762	1.40
133.1528015	0.28
134.8641968	4.69
138.9005127	0.88
140.0100250	0.14
145.0516357	3.19
156.2574310	0.25
161.9097900	44.30
163.0545044	2.41
164.0497437	0.35
166.8663330	0.41
180.0064392	10.30
195.0330811	6.61
196.0631104	3.03
198.8394318	1.55
208.8752747	0.55
211.3923035	0.21
223.9787292	0.12
227.0777588	7.68
241.0435791	4.00
253.2518005	0.56
259.1278992	100.00
273.9874573	0.70
275.0736084	31.49
278.1705933	7.91
279.0664368	0.68
291.1673889	1.09
324.1895142	0.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	442.8
Annotation	Unknow
Peak:m/z	Relative Intensity
190.8872986	1.11
206.8917694	9.68
263.0058289	0.56
269.1004639	0.25
274.8421936	12.99
290.7545471	100.00
292.8590393	0.51
306.9145813	0.84
344.8423462	1.43
352.8739319	0.57
355.8900452	0.17
358.7233582	55.65
374.6632385	2.41
382.8212585	1.00
396.8640442	0.48
424.9964905	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	341.0877
Annotation	Grevilloside F
Peak:m/z	Relative Intensity
112.9710770	0.11
115.0622330	0.04
117.1816254	0.04
130.1116638	0.10
132.2532654	0.08
132.9855957	0.63
133.9658508	0.11
134.9825134	6.42
136.2005005	0.03
160.9581146	28.76
162.2322998	0.12
163.1695557	0.12
173.1550598	0.05
176.0555420	0.10
177.1507568	0.32
178.9730835	100.00
188.2044373	0.05
189.0668182	0.11
193.1616211	0.28
200.0689240	0.04
202.9978180	6.72
204.0646362	0.03
205.2244568	0.07
211.8556824	0.03
221.0891724	0.34
233.1070557	0.77
234.2329102	0.05
243.0278015	0.04
244.9679565	0.06
251.1062012	2.75
252.1973877	0.17
253.2584534	0.04
260.0334473	0.13
261.2098999	0.02
281.1924133	3.62
287.2889404	0.07
297.2995605	0.31
299.4232788	0.09
311.2195129	0.04
323.2580261	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	588.0101
Annotation	Unknow
Peak:m/z	Relative Intensity
172.8814697	0.65
191.0497894	100.00
207.0999603	0.36
228.9896240	0.10
237.1881104	0.07
262.9685059	0.06
264.4102478	0.07
271.9243164	0.06
281.8250732	0.12
282.9024353	0.34
286.0084839	0.14
304.1181030	0.18
305.2013550	0.40
307.1430664	0.22
313.9497681	0.13
321.7283936	0.20
323.5355225	0.07
326.8198853	0.16
338.2696533	0.23
341.3496704	0.47
353.2030640	0.10
358.1343994	17.83
370.8559570	0.12
375.8765259	0.14
382.2247314	0.04
386.2232666	0.18
396.0577393	0.24
402.0473022	0.12
407.3955688	0.31
409.2261963	0.06
413.8135376	0.13
416.3073120	0.08
436.2351074	0.17
438.4978027	0.09
440.1506958	0.13
442.2281494	0.51
455.0422974	0.24
458.2283936	0.39
459.5238647	0.10
474.4421997	0.15
476.0961304	0.08
479.1233521	0.08
482.1970825	0.10
482.9581299	0.06
484.1544189	0.34
488.7309570	0.05
490.1755981	0.13
508.1783447	0.43
529.1442261	0.07
539.3960571	0.50
542.1314087	0.16
543.1617432	0.71
544.1222534	0.64
551.2876587	0.20
557.4561157	0.06
568.5733643	0.32
569.3606567	0.96
570.0878296	3.82
570.6900024	0.08
571.3026733	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	295.0856
Annotation	Unknow
Peak:m/z	Relative Intensity
96.9216919	28.67
98.9318848	0.76
107.0534668	0.09
109.1437531	0.05
112.8416595	0.08
115.0134811	0.04
119.8397217	0.04
135.0998230	0.18
153.1630249	0.17
162.8900909	0.05
164.0281677	0.07
169.0492859	0.58
171.0542755	0.10
194.8721008	0.26
197.1577759	2.18
207.3039246	0.15
208.2494812	0.04
215.1201172	100.00
216.2626343	0.11
218.1238403	0.09
219.6402893	0.05
233.1553345	20.02
249.3006592	0.03
251.1767578	6.96
257.9615173	0.04
259.1336060	0.28
267.2334900	0.08
275.2647095	0.16
276.1481934	0.06
277.1876221	8.59
295.3927002	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	268.05
Annotation	Unknow
Peak:m/z	Relative Intensity
108.6749878	0.07
136.2262421	0.25
151.7306519	0.12
157.2872467	0.05
162.0946960	0.08
163.9429016	0.26
178.1886597	0.33
181.1595001	0.23
186.0159607	3.71
189.9371643	0.10
192.1361237	0.05
195.9190826	0.14
198.2441864	0.11
204.0229645	100.00
206.0059662	0.21
210.9353485	0.27
212.1631470	0.53
222.3860016	0.67
225.1449432	0.05
226.9239960	0.61
232.1464691	0.39
233.0728760	0.30
235.9108887	0.12
238.2141876	0.10
239.0367279	0.25
240.0525055	0.35
249.9869385	4.83
251.2263641	0.14
252.1231842	0.19
258.5354614	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	413.1405
Annotation	N6-Carbamoyl-L-threonyladenosine
Peak:m/z	Relative Intensity
135.9141846	0.40
161.9826355	2.63
266.2631531	0.16
267.2954407	1.11
268.1059265	3.91
281.1062012	100.00
294.0869751	0.42
309.3735046	0.60
341.6110229	1.36
367.1778564	0.30
369.5623474	0.24
377.4968872	0.16
395.1146545	0.19
398.3650208	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	338.05
Annotation	S-Sulfanylglutathione
Peak:m/z	Relative Intensity
113.2966537	0.05
114.0056839	0.03
127.9712601	0.48
131.1103363	0.05
132.1795197	0.04
143.0141602	0.21
146.1600647	0.08
149.4584045	0.03
161.0548706	0.03
174.8656311	0.03
176.0412140	0.09
179.1311798	0.26
193.0357513	0.11
195.0952148	0.04
197.1353607	0.08
209.0924072	0.31
214.2716370	0.06
222.1874695	0.38
223.3491821	0.08
227.4583740	0.07
231.9044495	0.05
243.1257019	0.03
249.0950623	0.03
254.1610718	5.25
255.3049011	0.06
257.2707520	0.05
258.4715576	0.04
262.8771362	0.96
269.3330383	0.09
270.1614380	0.06
272.1287842	100.00
275.1487427	1.22
276.2216492	0.27
279.3079529	0.04
286.0819397	0.10
291.0084839	0.10
291.9544678	0.09
293.2662354	1.61
294.2284546	0.53
300.1015625	0.03
302.3999023	0.03
304.1831665	25.17
307.0737610	0.04
317.1316528	0.12
319.1879883	0.13
320.1643372	2.42
321.2111511	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	480.3075
Annotation	PC(15:1(9Z)/0:0)
Peak:m/z	Relative Intensity
139.0777130	0.03
150.9876099	0.04
153.1802979	0.14
170.6166840	0.04
173.1052704	0.03
175.4698486	0.03
184.0941925	0.10
187.8081970	0.14
191.2591095	0.06
197.8687134	0.30
216.1942749	0.04
221.2324524	0.06
239.0074768	0.05
247.3865967	0.06
251.2911072	0.16
255.3273621	0.05
257.2844543	0.06
265.1846619	0.67
273.2578430	0.13
293.1384888	0.22
295.4918823	0.14
301.0004272	0.07
308.4623413	0.83
320.0642090	0.06
321.4700928	0.23
325.2813721	0.07
326.6795349	0.06
334.4566040	0.05
335.2910156	0.07
339.3583984	48.42
345.4241943	0.07
362.2171326	0.06
363.0557861	0.05
370.7467041	0.09
373.3645935	0.15
375.1868286	0.09
376.4248657	0.03
382.3346863	0.11
389.4672546	0.08
392.1731262	0.12
408.3119202	0.11
419.1333313	7.02
419.7658997	0.07
423.8142395	0.09
431.1869812	0.06
435.0127869	0.06
437.1978149	0.56
444.0509338	0.29
448.5265808	0.05
450.2839661	0.06
462.1972351	100.00
463.4236755	0.44
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	1091.3256
Annotation	Unknow
Peak:m/z	Relative Intensity
384.5620728	0.18
385.1982727	0.06
411.3597412	0.10
427.3225403	0.80
456.9690552	0.28
481.0632019	0.80
485.3272705	0.20
487.6261597	0.16
497.3439941	0.19
499.3801880	0.95
511.1790771	1.73
521.1348267	0.33
525.0794067	0.10
529.2748413	1.05
559.4229736	0.30
590.4682007	0.04
633.3567505	0.51
635.3836060	0.11
663.2801514	0.10
669.3930664	0.09
675.2218628	0.14
687.0924072	0.51
691.4211426	0.12
705.2373047	23.87
722.9930420	0.52
723.6168213	0.18
735.2045898	1.79
752.6018066	0.09
753.5211792	0.16
771.0703735	0.08
782.5157471	0.14
783.5007324	0.18
815.4957275	0.09
866.7363281	0.20
867.4073486	0.29
885.2199707	0.49
893.1809082	0.11
917.4774170	0.30
929.1052246	100.00
929.9185791	0.04
939.3251953	0.09
965.4652100	0.22
971.1154785	1.56
983.3649902	0.14
1011.5153810	0.11
1014.7381590	0.08
1027.3522950	0.08
1030.0820310	0.12
1031.1701660	0.49
1046.4829100	0.34
1049.5100100	0.08
1051.2443850	0.19
1054.1928710	0.08
1055.7248540	0.11
1060.7121580	0.27
1072.5537110	0.65
1073.4938960	1.38
1092.7758790	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	399.1211
Annotation	Repensolide
Peak:m/z	Relative Intensity
114.8225479	0.04
117.2379608	0.04
128.2914734	0.02
129.9770050	0.29
130.8982544	0.02
132.0597687	0.38
160.0353241	12.50
162.1257019	0.03
174.0127563	0.08
176.1685791	0.06
178.0191345	0.04
179.0205383	0.04
184.9449768	0.02
186.1460114	0.23
186.8902588	0.05
189.3214417	0.03
192.1232452	0.27
200.1027832	0.01
202.1212006	0.36
203.1127167	0.04
204.1553192	0.21
207.3764496	0.03
211.1646729	0.04
217.2065430	0.04
219.0908813	0.65
220.1690979	0.16
221.1134796	0.37
222.1443481	0.09
222.8446808	0.04
227.2393494	0.03
228.0489197	0.04
231.2480774	0.02
232.3677368	0.04
235.2236023	0.02
236.9957275	100.00
237.8417664	0.02
247.0790710	0.51
249.0969849	0.21
253.0758972	0.04
255.0103455	0.01
257.1349792	0.08
258.3989563	0.03
261.1856384	0.16
268.2330322	0.04
269.3139038	0.02
269.9921875	0.04
277.1533508	0.04
279.0597839	4.73
281.9797058	0.04
283.1092224	0.03
284.3946838	0.02
286.2610779	0.39
286.9651489	0.02
292.7258301	0.12
299.0577087	0.04
300.3783569	0.02
303.2492065	0.05
304.2858887	0.06
309.1530762	0.04
312.2207947	0.03
315.0936279	0.30
318.4660645	0.08
322.2007446	0.65
323.3590698	0.06
324.3840942	0.11
325.2370605	0.06
328.3607483	0.03
329.9732056	0.05
333.0825806	0.16
345.1178894	1.43
346.3318481	0.07
348.8101807	0.02
351.1369934	0.11
354.1419067	0.05
355.3724670	0.02
358.5264587	0.07
363.3084412	0.66
364.4148254	0.12
365.2232361	0.03
366.1293640	0.17
367.1580505	0.69
369.3305054	0.03
380.2539062	0.05
381.3216858	1.66
382.1511536	4.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	306.1346
Annotation	Catuabine G
Peak:m/z	Relative Intensity
91.0333328	0.27
95.0074463	0.37
96.9571533	1.46
103.1637878	0.22
114.0541534	0.10
116.8547668	0.35
117.9315262	0.18
127.0115433	0.09
128.1884460	0.12
133.9664612	0.21
141.0195312	0.54
146.0006714	0.28
147.0800018	8.06
158.0430298	3.22
159.1467285	1.00
160.0431519	0.11
164.0248413	100.00
176.9689484	0.27
179.0153809	0.11
190.0776215	0.12
193.0871277	0.21
196.1693726	0.08
197.0243835	0.11
199.0199585	0.11
200.2740173	0.19
204.1004333	0.31
205.2711487	0.12
209.0891113	0.22
210.3865051	0.08
214.9651489	0.09
215.8769531	0.18
217.6287842	0.18
218.2465210	0.27
219.1602478	0.05
227.2594604	0.18
228.1536255	0.14
230.2014465	0.06
231.9036255	0.03
244.1281738	46.56
245.3668518	0.21
254.0224609	1.05
262.1975403	13.93
263.0093994	0.20
268.1166077	0.20
269.2256470	0.06
270.2305603	0.06
270.9601746	0.04
272.0473938	1.56
276.9038086	0.12
278.0473022	0.42
288.0957947	51.34
288.9806213	0.09
300.1938477	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	350.088
Annotation	Melicarpine
Peak:m/z	Relative Intensity
115.0159683	0.59
131.2916412	0.05
156.9860229	0.82
174.9744263	7.83
176.0378876	0.08
183.0608826	0.04
187.2497559	0.07
198.7485046	0.07
202.1686401	0.18
203.2117462	0.30
204.3000793	0.08
220.2915649	0.07
221.1733093	0.27
221.9309387	0.06
226.1061401	0.05
231.3358154	0.12
244.0495605	5.93
246.2750854	0.07
255.7618713	0.12
257.3169556	0.11
260.9648743	0.14
270.1337891	0.35
271.8795166	0.40
273.0924988	0.02
276.9702148	0.12
279.0035095	0.05
286.1337280	0.24
287.2957764	0.26
288.9387817	1.32
290.2677612	0.46
303.8422852	100.00
304.6585693	0.38
305.3700867	0.35
306.0410767	0.60
307.7291870	0.22
312.1085815	0.04
313.9540100	4.00
314.8391724	0.24
319.9435425	0.05
321.5929565	0.24
322.3719788	0.04
323.3248291	0.12
329.2205811	0.09
331.0929260	0.68
332.1991577	0.64
333.1301880	0.13
334.4272461	0.08
349.0136414	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	611.112
Annotation	Cefpiramide
Peak:m/z	Relative Intensity
179.0239258	0.02
184.0277405	0.01
186.2362976	0.02
201.0693665	0.02
201.9680023	0.53
203.4075317	0.01
244.1925659	0.04
253.1763153	0.02
254.1141663	0.02
262.1636963	0.06
271.0764160	0.03
272.2121887	0.04
285.3344116	0.01
286.3215027	0.04
289.0368347	0.04
303.3074951	0.03
304.0384827	0.02
306.1968994	0.05
329.1703491	0.04
333.3142090	0.12
336.2135010	0.03
338.0319214	0.09
341.1995850	0.02
345.5617676	0.02
346.2916870	0.01
347.2550659	0.01
352.1648560	0.02
363.1350098	0.85
364.2117920	0.13
386.4512939	0.09
403.2979126	0.03
406.0050659	0.13
407.9075317	0.25
422.3206787	0.01
430.2420654	0.02
431.5612183	0.03
436.4885254	0.03
440.4712524	0.03
444.8745728	0.01
449.3187256	0.15
459.6951904	0.02
482.3945312	0.01
490.9402466	0.01
492.4113159	0.03
495.3449097	0.03
496.5597534	0.01
504.2680054	0.02
525.4395142	0.84
526.4506226	0.01
533.0779419	0.03
548.9523315	0.07
550.2161865	0.01
551.4763794	0.01
567.1363525	100.00
568.0756226	3.09
568.7638550	0.06
592.2600098	0.06
593.5571899	0.07
594.2049561	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1011.7317
Annotation	Unknow
Peak:m/z	Relative Intensity
336.2246094	0.33
337.0745239	0.10
347.6329041	0.12
358.1087952	0.10
359.5759583	0.22
365.4535522	0.18
375.7470093	0.31
392.3230591	0.17
394.2001953	0.29
407.9195557	0.11
410.1652832	1.12
433.4769287	0.35
434.1335754	0.16
451.3004150	0.70
452.3879700	0.17
477.0015869	0.37
495.2617798	0.41
496.3641968	0.21
505.2607422	0.45
523.3248291	1.16
524.3170166	0.07
562.1671143	0.38
580.2156982	0.24
596.6453857	0.34
598.2468262	4.72
599.4638672	0.59
600.5919189	0.11
602.5419922	0.10
608.2428589	0.05
636.3840332	0.09
655.9135742	0.11
660.4330444	0.15
690.0683594	0.29
690.7478027	0.15
693.1021729	0.25
693.7134399	0.64
709.2349243	0.16
711.3389893	0.04
744.6920166	0.41
750.4884033	0.19
751.1684570	0.13
753.0220947	0.09
756.7678223	0.33
768.3299561	0.82
782.6690674	0.23
790.3000488	0.13
800.4257812	0.06
805.8170166	0.25
816.7197266	0.17
823.7934570	0.13
828.0675049	0.10
829.0999756	0.17
833.7154541	0.09
834.3500977	1.00
840.5181885	2.94
841.3288574	0.34
844.2899170	0.05
853.8298340	0.52
855.9401855	0.24
862.7293701	14.32
863.7402344	0.24
864.6657715	0.06
871.5410156	1.05
872.3146973	0.05
873.9730225	2.21
874.9678955	0.10
879.6699219	0.29
887.0714111	0.72
888.6673584	0.42
893.1286621	0.95
899.4252930	7.16
900.2617188	0.70
903.3964844	0.07
906.5927734	0.27
907.9521484	0.71
911.5653076	0.15
919.1068115	0.25
920.0898438	0.08
923.7006836	2.05
925.7414551	0.13
928.2958984	32.89
929.2731934	0.05
930.5479736	1.34
931.7801514	0.42
933.6821289	0.64
936.1240234	2.59
937.3103027	0.75
940.0478516	0.17
940.7089844	0.59
945.1903076	0.64
947.0930176	0.40
947.7490234	0.56
952.5080566	0.20
953.7565918	0.87
956.3923340	1.78
958.0357666	23.37
959.5639648	0.19
960.5866699	5.18
962.9117432	0.53
964.4816895	1.92
965.0842285	57.32
965.9077148	4.77
967.0749512	1.08
967.9074707	1.18
969.0930176	11.87
970.1154785	0.84
970.8911133	0.21
972.1821289	1.11
973.2419434	0.19
975.6021729	0.05
979.9377441	0.49
981.9635010	1.78
984.1376953	0.55
984.9096680	0.49
986.1390381	0.55
986.8544922	0.49
987.8249512	0.91
988.7982178	9.06
989.4223633	0.06
990.0355225	0.21
990.6943359	0.35
993.3771973	92.83
994.8304443	1.87
995.7720947	0.80
996.7084961	1.59
997.5161133	1.81
998.7602539	0.35
1000.2397460	0.58
1003.0815430	0.20
1004.2333980	0.40
1005.2039790	0.51
1023.0085450	0.54
1031.6856690	1.07
1034.3439940	0.65
1039.7711180	2.07
1040.8283690	2.97
1041.5593260	1.30
1045.4262700	0.31
1051.6014400	0.08
1055.0966800	0.66
1059.5573730	0.11
1063.6859130	0.39
1065.4620360	0.10
1076.6606450	0.45
1079.2532960	0.39
1080.5434570	0.45
1086.3332520	0.52
1087.7927250	0.95
1090.7489010	0.13
1093.2336430	18.58
1094.1889650	0.28
1100.0928960	0.16
1104.7510990	0.42
1109.5764160	0.15
1111.9770510	3.02
1112.6434330	5.71
1113.9530030	0.32
1115.2812500	0.19
1116.3211670	0.35
1121.3234860	0.21
1122.7829590	0.23
1131.0429690	0.27
1132.7587890	0.12
1137.6987300	0.09
1140.7375490	1.58
1141.8156740	0.18
1143.8236080	2.90
1144.5960690	0.34
1150.0012210	100.00
1150.8321530	2.79
1151.9555660	0.69
1153.5268550	0.12
1155.7253420	0.10
1158.9401860	0.12
1160.9897460	0.41
1162.3747560	0.13
1163.8260500	0.29
1164.9230960	0.11
1176.0603030	0.76
1183.8657230	0.46
1184.4724120	0.71
1186.9447020	0.49
1188.3212890	0.08
1190.0870360	0.41
1191.6188960	0.08
1192.9799800	1.19
1198.4577640	4.09
1199.1184080	61.05
1201.0816650	0.88
1203.7102050	0.26
1204.9183350	0.37
1208.9316410	0.27
1209.8413090	0.31
1217.5106200	0.11
1231.4073490	0.74
1235.4591060	0.05
1237.3815920	60.64
1238.5893550	0.82
1239.7521970	1.13
1240.4530030	0.08
1247.7667240	0.19
1260.0717770	1.33
1271.7055660	0.63
1274.5043950	0.53
1275.2653810	0.48
1277.6191410	0.91
1280.5364990	1.78
1282.4426270	0.24
1285.8105470	1.52
1286.4150390	37.43
1287.2723390	1.44
1287.9605710	0.32
1289.6972660	0.06
1297.7864990	0.22
1313.3321530	0.10
1314.3138430	0.30
1317.4234620	0.82
1321.5717770	0.10
1323.5448000	0.36
1324.2373050	0.29
1333.0655520	0.43
1350.8276370	0.10
1365.9425050	0.18
1370.8508300	0.36
1373.2630620	0.30
1390.7895510	0.14
1402.5091550	0.14
1404.8492430	0.45
1407.8450930	0.13
1409.6138920	0.18
1423.8624270	0.45
1427.0617680	0.26
1432.2423100	0.38
1446.6585690	0.21
1450.4843750	0.17
1451.7528080	0.19
1453.0919190	0.27
1454.0289310	0.18
1464.1097410	0.06
1492.3303220	0.17
1500.1094970	0.26
1506.5250240	0.20
1526.6666260	0.25
1527.5068360	0.10
1552.9597170	0.14
1589.6270750	0.22
1622.8302000	0.21
1648.6643070	0.23
1661.9637450	0.27
1698.8084720	0.11
1700.8929440	0.17
1703.8176270	0.08
1796.6437990	0.17
1802.4265140	0.05
1819.2547610	0.10
1827.1405030	0.12
1831.5632320	2.16
1832.8819580	0.05
1842.5568850	0.37
1865.3592530	0.12
1866.3524170	0.06
1872.7048340	5.86
1873.8182370	1.00
1879.1173100	0.09
1889.7388920	0.19
1893.9720460	0.21
1898.0357670	0.36
1899.3111570	0.29
1908.7606200	0.07
1917.6668700	4.05
1921.5252690	0.32
1930.1702880	20.25
1931.3161620	0.25
1932.3142090	0.26
1939.4050290	0.34
1951.5979000	0.07
1967.6629640	0.49
1968.9942630	0.74
1971.5308840	0.22
1972.1444090	5.30
1974.1604000	6.09
1976.2337650	0.19
1977.7364500	1.20
1978.5745850	2.59
1986.1138920	0.25
1992.5950930	6.39
1994.0111080	42.90
1995.1472170	0.24
1999.7569580	0.34
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	579.073
Annotation	Fasmerianamine A
Peak:m/z	Relative Intensity
219.8255615	0.21
281.4956665	0.68
287.2586670	0.14
303.2388306	0.40
320.3207397	0.94
334.2943726	0.18
336.6573486	0.61
344.1367798	0.22
347.1832275	0.33
347.8187866	0.22
379.2042847	0.32
382.1937256	11.05
410.4498901	0.53
414.1833496	0.26
415.5594482	0.72
417.3676147	0.75
431.2196045	0.23
443.2727051	0.93
445.8853760	4.44
446.7552490	1.93
449.2520142	0.69
460.3065796	0.75
461.9170532	100.00
463.9532471	0.96
471.7316284	0.55
477.9691772	1.57
478.7395630	0.67
481.2501831	0.35
490.3342896	0.18
498.2512817	0.50
499.0267334	0.16
501.2891235	0.27
514.3032227	0.21
532.2269287	0.51
539.4711304	0.14
559.9510498	0.45
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	549.21
Annotation	Unknow
Peak:m/z	Relative Intensity
162.9198303	5.39
206.9172363	2.77
208.7715759	1.65
236.9116364	0.83
254.9217682	100.00
324.8970947	11.71
364.9682617	0.40
369.1738281	0.67
377.4501953	0.83
378.9567871	53.00
402.3243408	1.49
403.2767334	2.20
416.7067871	47.21
417.4598389	4.29
448.0730591	1.87
451.5000610	1.34
456.9523926	1.35
474.3163452	5.51
532.0481567	1.44
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	342.98
Annotation	Unknow
Peak:m/z	Relative Intensity
128.9077911	0.49
145.0738983	0.14
172.8757019	0.16
185.8858795	0.23
199.0091858	0.14
206.8785095	1.11
214.3366394	0.15
236.9958496	12.24
238.1647644	0.81
239.1823425	0.28
240.0848694	1.21
241.2518005	0.22
253.1082153	0.82
256.9913330	0.62
259.0215454	100.00
259.6260376	0.20
266.8566284	2.26
278.7627869	0.41
283.0881348	0.52
294.0422363	0.41
294.8370667	0.38
296.9519043	43.36
314.0295105	0.10
324.1563721	2.68
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1112.8671
Annotation	Unknow
Peak:m/z	Relative Intensity
325.4154053	0.14
326.1536865	0.04
339.4094543	0.05
360.3728638	0.09
378.3427734	0.45
384.2512817	0.13
414.4304810	0.05
419.0214233	0.11
421.3177185	0.21
423.2330322	0.09
460.1454773	0.10
471.3506470	0.10
478.6677246	0.05
495.2396240	0.11
495.9492798	0.04
511.1061707	0.12
522.5951538	0.36
525.4655762	0.06
538.4673462	0.19
546.4988403	0.42
552.2651367	0.11
554.3264160	0.08
563.9756470	0.45
565.3035278	0.19
568.4196777	0.12
569.5198975	0.16
570.4293213	0.27
579.5183716	0.14
582.2774658	0.44
587.4465332	0.04
608.5294189	0.12
618.9505005	0.23
629.0589600	0.07
637.8331909	0.19
639.5373535	0.13
640.4625244	0.12
650.5643311	0.14
657.3106079	0.26
666.3519897	0.07
670.0378418	0.28
674.5184937	0.86
675.7673950	0.06
678.9825439	0.09
683.1768799	0.03
692.1787109	1.17
693.3698730	0.37
694.4691162	0.10
700.3895264	0.34
701.0952148	0.04
705.2630005	0.40
709.8652344	0.21
712.6257324	0.09
736.4675293	0.31
738.6813965	0.11
747.5155029	0.07
753.1060181	0.10
754.4769287	0.44
758.5729980	0.17
772.4172974	0.04
773.4437866	0.06
774.3085938	0.27
782.8087769	0.14
791.3977051	0.40
793.4213867	0.32
800.2920532	0.08
802.5910645	0.16
805.0311279	0.50
805.7184448	0.57
808.3886719	0.12
809.5716553	0.17
811.7813721	0.14
825.4786377	0.14
826.4822998	0.11
830.8695068	0.29
832.0822754	0.20
840.9110107	0.10
844.4327393	0.04
845.2991943	0.04
846.0849609	0.24
848.0509033	0.60
848.9197998	0.39
855.2467041	0.22
861.2961426	0.26
862.4055176	0.33
863.4945068	0.11
871.7197266	0.09
874.6348877	0.10
878.4726562	0.13
881.5633545	0.19
889.6718750	0.45
890.3199463	1.28
890.9260254	0.81
891.6854248	0.33
894.8266602	0.05
895.6446533	0.36
896.6343994	0.27
898.3247070	5.86
899.0600586	0.30
899.7698975	0.04
903.2359619	0.18
905.6308594	0.25
911.7498779	0.26
917.5144043	0.10
919.3258057	0.49
921.0020752	0.06
924.2154541	0.12
925.6568604	1.89
928.3618164	0.28
929.5274658	0.31
930.8168945	0.59
933.7547607	1.53
934.4270020	0.03
939.7457275	2.65
940.5535889	0.59
944.7857666	0.28
949.3427734	0.49
950.4952393	0.29
952.9075928	0.42
954.4764404	0.90
955.3894043	0.74
956.0607910	0.14
965.6822510	0.17
966.8165283	0.06
974.3609619	0.20
978.0261230	0.22
979.6973877	0.17
981.1291504	0.63
981.7482910	0.69
983.3743896	3.09
984.1840820	0.34
985.9395752	0.04
991.0162354	1.33
991.6201172	0.65
992.3768311	0.24
993.9211426	0.44
995.3808594	0.73
996.8391113	1.25
997.5705566	1.38
999.7558594	4.85
1000.6909180	0.55
1003.9217530	1.13
1004.6198730	0.10
1006.2879640	1.01
1007.2269290	0.90
1010.1921390	0.60
1011.7919920	0.87
1012.5505370	0.29
1016.0814210	2.57
1016.6861570	1.05
1019.2495120	0.75
1020.5688480	0.42
1022.0850830	1.11
1023.9030760	0.52
1024.7464600	0.35
1029.4851070	1.01
1032.9194340	2.81
1034.1700440	0.23
1039.2253420	1.19
1040.0305180	0.15
1040.9370120	0.18
1045.2351070	14.30
1046.0097660	2.65
1047.2946780	2.09
1048.1398930	0.08
1049.5295410	0.23
1051.2280270	100.00
1052.0769040	5.12
1053.1301270	2.38
1053.7452390	0.63
1054.5952150	0.45
1055.5587160	0.27
1057.0922850	0.28
1058.7185060	3.10
1059.6229250	2.52
1060.4965820	0.14
1066.0986330	0.31
1072.3658450	0.33
1078.4147950	1.49
1082.8824460	0.08
1084.2880860	0.98
1087.4565430	0.22
1092.4626460	0.19
1093.4403080	0.03
1095.4018550	0.32
1096.5480960	1.67
1097.3012700	0.84
1097.9509280	0.40
1099.1875000	2.36
1099.9481200	0.18
1101.3641360	0.46
1123.6661380	0.26
1127.7512210	0.14
1137.1268310	0.17
1140.8623050	0.28
1145.3880620	2.54
1146.4396970	0.66
1147.2274170	0.20
1150.1206050	0.56
1151.6274410	0.05
1154.4898680	0.30
1155.3216550	0.20
1156.6274410	0.04
1163.6972660	1.38
1164.4245610	0.40
1168.9017330	0.05
1171.0834960	0.06
1177.3371580	0.07
1181.1667480	1.31
1182.0205080	0.11
1183.0937500	0.11
1183.7933350	0.16
1186.7757570	0.22
1193.5515140	0.34
1194.8317870	0.09
1215.8220210	0.07
1217.0255130	0.05
1218.5147710	0.32
1220.6973880	0.64
1221.5795900	0.27
1224.2375490	0.77
1230.0875240	1.72
1230.8862300	3.37
1233.0234380	0.58
1234.0722660	0.16
1238.2862550	2.43
1239.2894290	0.62
1240.3676760	0.08
1241.7009280	0.06
1242.9765620	0.25
1252.5323490	0.12
1255.0695800	0.20
1263.6582030	0.37
1264.7318120	1.40
1265.6589360	0.12
1274.0527340	4.00
1274.9196780	0.29
1275.8247070	0.15
1277.0131840	0.14
1280.3664550	0.24
1284.3145750	0.40
1285.4532470	0.17
1286.2174070	0.13
1289.2907710	0.33
1292.5087890	2.07
1293.3391110	0.48
1294.0512700	1.57
1294.8929440	1.67
1298.5671390	0.11
1302.8117680	0.29
1313.5018310	0.36
1314.6757810	0.77
1320.5545650	0.64
1321.8419190	0.10
1323.4976810	6.07
1324.2022710	2.12
1326.5975340	0.78
1327.4230960	0.20
1328.8326420	0.30
1336.8802490	0.32
1338.8074950	0.04
1348.0391850	0.18
1349.5892330	0.75
1354.7987060	0.05
1356.6673580	1.72
1357.4376220	0.75
1358.5472410	0.10
1359.9483640	0.17
1366.1024170	3.39
1366.8214110	1.93
1367.4447020	0.12
1372.8702390	2.09
1373.7515870	1.25
1374.8254390	0.33
1378.9830320	0.18
1383.9005130	0.13
1387.6939700	4.15
1388.6837160	1.01
1391.8099370	0.15
1396.5444340	0.28
1411.0013430	0.09
1421.6475830	0.81
1422.5115970	1.06
1428.5119630	0.41
1430.0562740	0.53
1430.7661130	1.88
1431.6444090	2.19
1432.6816410	0.19
1439.5137940	0.09
1447.3299560	0.29
1458.5535890	0.12
1459.3431400	0.34
1461.9630130	0.24
1466.6246340	0.18
1471.7745360	1.45
1474.9993900	0.09
1475.8811040	0.37
1480.6682130	2.20
1481.9564210	0.34
1487.8580320	0.13
1489.4726560	0.22
1491.0745850	0.24
1499.2673340	0.84
1499.8878170	0.09
1505.7969970	0.13
1513.0135500	0.18
1514.7923580	0.48
1515.6292720	0.18
1518.3795170	0.17
1524.1971440	1.07
1525.0157470	0.07
1526.3909910	0.04
1527.7132570	0.84
1528.3406980	0.44
1537.0776370	0.10
1542.7320560	2.55
1543.8021240	0.68
1544.5930180	0.06
1546.6893310	0.06
1547.9459230	0.13
1559.2716060	0.19
1567.3411870	0.41
1576.3231200	5.08
1577.1497800	0.67
1586.6154790	0.24
1588.6744380	0.04
1599.9486080	0.39
1609.2183840	0.24
1625.1535640	0.29
1634.8378910	0.13
1650.1950680	0.15
1661.8912350	0.07
1680.1300050	0.15
1689.9278560	0.19
1696.4573970	0.65
1711.0157470	0.09
1711.7141110	0.15
1722.6027830	0.10
1728.3103030	0.08
1729.0052490	0.53
1729.7810060	0.12
1744.6638180	0.05
1778.1751710	0.03
1795.2044680	0.11
1796.1053470	0.23
1797.9329830	0.04
1809.1896970	0.12
1813.3415530	5.95
1820.2805180	0.12
1823.7419430	1.50
1828.9613040	0.04
1831.9984130	0.05
1851.8262940	0.15
1875.5189210	0.10
1877.5616460	0.05
1878.2615970	0.06
1879.1627200	0.02
1892.1529540	0.06
1894.0850830	1.07
1904.4333500	1.80
1915.5858150	1.49
1918.8895260	0.11
1921.6325680	3.95
1927.5124510	0.06
1929.5535890	0.66
1930.8531490	0.10
1934.8822020	0.06
1942.3029790	0.09
1945.8391110	0.06
1949.0900880	0.08
1954.0767820	0.04
1959.6185300	0.16
1964.4172360	0.27
1965.9060060	0.24
1967.9093020	0.73
1974.4554440	11.65
1975.3654790	10.32
1981.3375240	0.08
1986.4542240	0.12
1989.6437990	0.78
1994.2199710	0.11
1997.3712160	1.85
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	556.1042
Annotation	Unknow
Peak:m/z	Relative Intensity
162.0397186	2.89
227.0860443	0.06
248.9336395	0.15
298.3862305	0.03
306.2774048	0.11
307.2470398	0.07
308.2340698	0.11
310.2893677	0.03
339.9068604	0.04
349.4819946	0.05
350.3232422	0.03
352.2474976	0.13
358.6336670	0.05
359.3699341	0.12
367.1332397	0.05
368.4123535	0.19
374.2285767	0.07
381.6229248	0.03
391.2393799	0.06
393.2553101	0.03
394.2402954	0.02
409.9755249	100.00
410.6789551	0.06
433.2278442	0.04
434.0422974	0.06
439.4223022	0.15
443.4605103	0.08
459.9324341	0.13
466.5565186	0.07
469.3814087	0.05
474.7832031	0.12
475.5678101	0.04
479.6278076	0.15
515.0916138	0.06
528.3193359	0.03
536.1710815	0.03
537.4223633	0.02
538.1378174	0.05
541.0250854	0.04
546.4866333	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1222.31
Annotation	Unknow
Peak:m/z	Relative Intensity
358.3113098	0.33
374.0209351	1.00
398.0392761	0.11
399.5170288	0.61
410.8189087	0.20
444.2838135	0.27
450.2045898	0.60
451.3007202	0.21
467.4368896	0.46
469.2399292	0.62
483.2772217	0.67
501.5697632	1.24
503.4051208	2.51
505.4260864	0.23
509.6168213	0.23
519.4240112	1.98
535.5375366	0.30
540.6311035	0.34
541.5928955	0.39
564.4740601	0.21
572.5480957	1.01
574.3081055	0.18
577.4617920	0.57
586.6345215	0.47
590.4869385	0.17
596.3309326	0.39
631.1134033	1.86
637.6567383	0.29
643.9133301	2.72
644.9004517	2.36
645.5240479	0.14
648.0819092	1.06
653.4536133	0.17
655.3928223	0.99
662.4288940	0.15
665.5214844	0.34
668.6372070	0.47
673.3887939	0.43
676.9313965	0.61
680.5218506	1.65
685.0922852	1.07
685.8092041	0.55
689.3575439	0.70
693.8294678	0.18
698.6240234	0.44
703.0609131	0.30
714.9908447	0.56
716.4666748	0.55
718.5706177	0.73
726.3505859	1.58
727.5709229	0.59
728.6154785	0.37
730.4387817	0.14
734.4180908	1.05
737.1942749	0.12
743.1275635	4.13
744.4117432	3.15
745.5158691	1.85
747.5254517	0.43
769.6018066	0.61
774.8637695	3.26
775.7681274	0.44
776.7210083	0.61
778.2286377	0.24
782.3981934	0.21
788.7078857	2.58
797.1196289	0.43
799.3755493	0.27
800.5224609	0.73
801.4002075	0.54
820.8791504	0.87
821.6221313	0.30
827.3107910	0.19
833.6352539	1.07
836.8629761	2.55
837.6553955	2.07
841.0001221	0.39
843.6137695	0.49
845.6202393	0.95
846.4371338	1.04
851.4437256	0.76
856.6317139	0.44
861.6525879	0.63
863.1008301	1.69
867.5628662	1.75
869.9619141	1.96
870.7016602	1.37
873.8814697	0.32
875.7049561	1.39
877.6998291	0.56
889.5668945	3.18
891.9700928	1.24
894.2703857	1.32
900.0518799	2.03
901.0588379	0.79
902.0778809	0.17
903.3253174	1.76
913.5502930	1.68
914.2083740	2.51
916.6518555	0.52
926.0852051	0.53
927.8958740	1.26
930.1156006	0.43
940.9157715	0.75
942.6115723	0.36
946.9130859	2.55
951.9239502	4.93
952.6763916	3.31
954.2425537	0.34
959.8504639	0.30
960.8294678	0.71
961.8349609	0.34
965.1544189	1.68
965.8151855	2.01
968.8386230	0.44
973.6744385	0.19
974.7840576	1.29
983.7318115	2.56
984.4669189	0.68
985.3417969	0.28
986.7525635	1.26
988.0487061	2.35
988.6821289	0.22
989.9095459	25.29
990.8508301	4.91
992.6053467	1.24
993.2946777	1.30
994.6380615	2.87
998.8465576	1.49
1002.4925540	1.95
1005.3391110	0.28
1007.1840820	1.93
1013.4082030	0.49
1014.5917970	2.37
1023.4130860	0.26
1024.7434080	0.97
1026.4731450	2.53
1031.7026370	0.68
1033.1010740	1.08
1041.1981200	0.15
1045.6682130	1.00
1046.6706540	1.60
1047.3964840	0.31
1049.4368900	2.17
1056.2026370	3.36
1056.9331050	0.36
1062.7038570	1.93
1070.9583740	0.72
1072.8208010	0.69
1074.6197510	0.59
1075.5335690	3.37
1077.6948240	1.38
1079.6372070	0.89
1081.5178220	1.96
1082.1906740	0.79
1084.3652340	0.67
1088.4765620	0.67
1090.4609380	4.89
1091.3037110	2.43
1092.7720950	0.32
1094.0922850	1.67
1095.2800290	4.04
1100.4875490	0.78
1101.8936770	0.27
1103.0979000	1.98
1105.1990970	0.24
1111.0009770	1.36
1111.9797360	3.17
1112.6145020	1.72
1113.3859860	0.47
1114.0206300	0.92
1117.6768800	1.46
1119.2590330	2.43
1120.8325200	2.80
1122.8206790	4.81
1123.5546880	3.34
1124.9267580	0.65
1128.6486820	0.23
1129.3081050	1.42
1131.4385990	2.54
1133.5720210	0.27
1142.1639400	0.94
1143.0200200	2.25
1143.7520750	1.62
1146.2550050	3.69
1147.0008540	1.51
1147.7376710	3.52
1149.4627690	0.31
1151.4334720	0.74
1152.7910160	0.43
1153.7043460	1.47
1154.7199710	0.46
1155.7805180	0.33
1157.2497560	1.50
1159.5659180	2.10
1163.3055420	1.14
1166.5351560	39.15
1167.2583010	6.03
1168.3078610	2.54
1169.7165530	0.44
1170.5622560	2.03
1172.0954590	9.65
1172.9748540	2.45
1173.8455810	2.80
1175.1254880	1.66
1176.1308590	0.62
1177.7623290	12.53
1178.4316410	51.16
1179.2878420	4.34
1180.4493410	2.80
1181.3200680	1.24
1182.4676510	1.43
1185.5137940	0.30
1186.4147950	3.25
1190.3474120	3.57
1192.2401120	2.27
1192.9913330	8.31
1194.3547360	12.01
1195.5355220	7.57
1196.7392580	2.34
1197.3591310	1.22
1198.1496580	0.59
1199.2587890	0.47
1200.6525880	11.07
1201.9198000	6.55
1203.1457520	54.48
1203.8459470	10.76
1205.1687010	6.75
1205.8193360	100.00
1206.8728030	4.87
1208.4366460	25.30
1209.4876710	2.07
1210.2352290	0.95
1212.0444340	0.77
1220.6311040	0.18
1223.0931400	0.85
1230.6115720	2.41
1233.2377930	0.18
1233.9001460	1.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	929.2739
Annotation	2-Feruloyl-1,2'-disinapoylgentiobiose
Peak:m/z	Relative Intensity
259.1843567	0.69
260.6346436	0.07
265.1575623	0.81
265.9712524	0.06
270.4125671	0.04
272.2275391	0.06
273.2436829	0.08
275.2222595	0.16
276.2440491	0.03
277.2186584	0.14
278.2543030	0.04
283.1598816	0.05
287.1809998	0.07
289.1128845	1.78
290.1792908	0.23
295.1036682	0.34
296.0910645	0.10
301.1638794	0.31
303.0848999	0.20
305.1040649	0.28
313.1043396	0.11
325.0319214	0.14
326.1264038	0.17
331.1450195	0.84
337.1989136	0.10
348.8463135	0.07
367.1597595	1.04
368.3025208	0.14
371.4875183	0.11
373.1780396	0.03
385.0941772	1.15
386.2697449	0.12
393.1548462	0.05
395.5343628	0.06
399.1799316	0.19
404.4428711	0.04
407.2152710	0.04
411.2166138	0.07
413.3240356	0.36
419.3549194	0.04
427.2647705	3.61
428.1742554	0.25
436.3363647	0.06
439.5448608	0.47
443.0206299	0.09
451.5534058	0.18
453.1289673	0.12
457.2087402	3.22
458.0905151	0.22
465.4207764	0.19
467.2259521	0.63
469.1221924	3.44
470.2528076	0.61
476.7229004	0.16
477.5331421	0.15
481.2410278	5.17
482.2618408	0.83
484.2177734	0.08
485.2902222	0.11
487.1614380	1.94
488.1392212	0.14
494.5405884	0.06
497.1402588	0.40
499.2064819	5.33
500.3229370	1.09
507.2952881	0.03
508.3502197	0.06
511.2202148	7.37
512.2598877	1.41
515.3103027	0.29
524.9097900	0.06
526.1737671	0.09
529.2396240	3.22
530.2860107	1.27
536.4302979	0.10
562.0657959	0.06
592.0307007	0.03
594.3996582	0.10
597.1779785	0.06
605.4641724	0.09
606.5543213	0.15
609.0933838	0.11
615.2789917	0.05
617.3811646	0.13
621.2960815	0.10
623.2964478	0.05
631.6263428	0.02
633.1342163	0.66
633.9413452	0.12
635.5112305	0.17
636.2684326	0.06
637.5878296	0.14
644.3833008	0.05
645.2268677	0.45
646.3779907	0.06
647.0968018	0.29
663.0570068	1.46
664.2047729	0.35
669.2055664	0.03
675.3295898	0.04
676.2130737	0.07
687.3442383	1.17
688.2396851	0.23
691.2292480	0.93
692.3178101	0.32
693.1933594	0.80
694.1201172	0.17
705.1958008	100.00
706.2245483	25.84
707.0120239	0.19
716.8849487	0.13
718.2753906	0.09
719.1838989	0.29
720.8012085	0.05
723.1206055	2.65
724.2732544	0.89
728.7360229	0.08
729.5112915	0.19
730.9630127	0.12
731.6334839	0.04
735.1965942	3.76
736.2708130	0.90
738.3319702	0.10
743.6784668	0.06
751.5354614	0.02
752.6942749	0.04
753.4050293	0.35
754.2872925	0.40
759.8375854	0.04
762.6694946	0.15
764.3940430	0.31
783.7673340	0.03
787.6445312	0.08
797.3619995	0.11
800.7201538	0.13
805.2540894	0.44
806.6024780	0.06
807.2999878	0.03
808.0081177	0.07
808.8552856	0.05
831.4468384	0.09
842.3088989	0.07
849.4091187	0.14
850.8085327	0.04
851.6866455	0.35
852.5291748	0.24
853.6620483	0.03
868.1203613	0.08
868.7982178	0.11
869.4142456	0.03
885.4882202	1.41
886.2610474	0.17
896.8919067	0.08
898.4485474	0.03
899.5310669	0.02
904.8701172	0.12
905.6943359	0.04
911.2593994	0.64
912.0693970	0.30
914.3551025	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	256.0809
Annotation	Nicotinate D-ribonucleoside
Peak:m/z	Relative Intensity
81.1276703	0.12
88.5872803	0.04
115.0615692	0.07
123.9234314	100.00
124.6913300	0.05
133.1002045	0.03
134.1238556	0.05
138.0805969	0.35
141.9381714	0.07
147.1428986	0.03
155.0234985	0.15
156.2388916	0.05
161.0191803	0.02
168.0646515	0.05
169.2945557	0.04
170.2442780	0.11
175.9057312	0.12
193.9569855	0.12
199.1760254	0.09
209.8350220	0.04
211.2401886	0.10
212.0977020	0.04
215.0064850	0.04
219.2684784	0.08
227.3830109	0.06
228.0436249	0.29
237.1320190	0.46
238.0629120	0.53
239.1043549	0.27
246.4735718	0.11
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
123.9952545	4.06
127.2579956	6.94
153.8786621	1.68
161.1698608	10.59
184.2182007	4.72
205.6304626	6.46
211.0751953	3.42
212.1909485	12.87
214.194397	2.55
226.2887573	11.41
233.2741394	4.86
235.0757141	5.59
238.8832092	2.95
242.3535767	6.50
243.3868103	11.18
245.2020569	4.08
251.9762878	5.41
255.0897217	9.63
273.0989075	2.99
283.8772278	4.50
286.0849304	11.36
292.9110718	10.21
295.276001	1.89
326.2359009	8.35
331.9326782	6.96
335.5474548	7.77
338.0983276	2.78
339.2585754	11.09
341.3261108	3.86
343.1712036	4.74
350.8580627	6.41
363.2442017	12.28
366.5721741	9.62
367.2633972	2.33
370.1993408	10.01
376.7832336	4.74
379.0469971	5.38
380.1439514	18.10
381.1145325	33.28
383.3637695	10.76
384.6156616	14.26
385.5603333	2.35
388.3055725	3.64
390.4928894	4.95
391.393219	15.74
394.4839783	13.99
395.3817139	6.35
397.4853516	11.28
398.6272278	16.38
407.4096985	21.27
408.2721863	100.00
409.3429565	5.62
411.039032	11.74
424.9114075	5.62
426.5437622	3.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	367.1144
Annotation	trans-3-Hydroxycotinine glucuronide
Peak:m/z	Relative Intensity
127.0887756	0.09
132.2521057	0.17
142.7768707	0.06
144.3039551	0.05
145.1825409	0.05
147.1508179	0.10
149.0084839	0.51
156.7581635	0.05
159.9848938	0.06
161.0400391	0.26
162.1228333	0.05
162.9341736	0.06
165.2216187	0.07
167.0022888	0.04
169.9721680	0.06
170.8437805	0.06
172.9422607	0.92
174.0353394	0.24
175.1733093	0.28
184.3150330	0.13
185.2144012	0.06
187.1304016	0.56
189.0489960	4.45
189.9850922	0.19
190.9819489	0.03
192.8845978	0.37
195.4056244	0.05
199.2146759	0.09
200.1507263	0.21
201.0616150	0.06
202.0601349	0.72
203.0219116	7.36
204.0535126	3.30
204.9821167	2.42
206.1591492	0.14
212.2320251	0.13
215.0226746	0.67
217.0808411	0.55
218.7884521	0.21
223.0185852	0.12
226.1098938	0.06
227.1024780	0.17
228.9400024	0.71
230.4417114	0.18
231.3898926	0.15
232.1485901	0.24
233.2133484	0.07
234.2885437	0.06
235.0856018	0.08
241.0779114	0.11
241.7485657	0.04
245.0954285	1.22
247.1096802	0.54
249.0209351	0.04
252.1635132	0.11
253.2864990	0.06
257.0256348	0.13
259.4317017	0.06
262.2748718	0.03
265.2279358	0.09
271.0247803	0.11
275.2283325	0.06
277.0743103	0.09
279.1555786	0.08
280.1021729	0.21
286.3050232	0.07
287.1403198	0.03
299.0820923	0.07
304.7431641	0.11
306.3233948	0.06
321.5097046	0.24
323.4635925	1.22
324.1460571	18.68
329.4130859	0.03
334.2302246	0.13
335.2346802	0.26
336.1199341	0.38
338.9087830	0.11
347.2450256	0.46
348.0446472	0.36
349.1651001	0.25
350.3385010	0.09
352.1220093	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.0714
Annotation	7-Hydroxy-3-Methylflavone
Peak:m/z	Relative Intensity
96.82940674	0.52
101.0309906	0.24
125.7956543	0.51
129.2852631	0.28
141.0791931	0.69
148.9242096	2.38
155.1092682	0.39
166.962677	0.92
174.0070343	0.35
179.0907745	1.19
180.1782684	0.83
181.9332581	0.33
183.220047	2.04
190.0746002	0.45
192.3817596	0.20
193.1737366	0.34
194.0372925	0.82
195.0391846	0.43
197.2723846	0.65
204.8284607	0.94
205.9866486	1.73
207.0571442	11.44
208.0656891	14.20
209.2460175	3.24
210.2786102	0.69
216.0128784	0.88
216.8753204	2.55
219.2645416	0.35
220.937973	0.43
222.190155	13.02
223.0778961	12.23
224.1665192	8.23
225.2318268	0.35
233.0758209	2.79
234.0283966	1.11
235.0155487	1.43
236.0531769	0.63
251.0727997	100.00
252.2115326	32.04
253.0856323	3.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	175.02
Annotation	2-Dehydro-D-glucono-1,5-lactone
Peak:m/z	Relative Intensity
56.9440155	0.16
58.8728561	2.12
59.4839439	0.04
68.8746948	0.03
70.9416046	6.48
72.9298172	1.90
75.0489960	0.19
82.8812256	0.49
84.9129181	4.11
86.1530456	0.22
86.8265839	2.43
94.9686279	0.37
99.0259247	0.28
100.9168701	3.29
103.0697937	0.09
112.8703156	7.07
114.8589172	100.00
126.8850098	2.62
128.9523163	0.67
130.8993683	3.09
132.1504364	0.03
138.9164276	0.02
145.0244293	0.20
147.0881348	0.45
156.9988861	0.62
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	411.1393
Annotation	Unknow
Peak:m/z	Relative Intensity
191.1317902	0.64
193.1240234	0.31
194.0178528	0.11
220.6249084	0.21
225.0352936	0.20
268.3544922	0.17
280.1887207	0.17
312.1391602	0.54
331.0650024	0.54
338.0435486	0.22
349.2318115	4.56
375.3217468	2.13
382.4562988	0.45
393.2317505	100.00
394.2451477	0.47
402.6861572	0.35
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	426.2874
Annotation	Prostaglandin E2 serinol amide
Peak:m/z	Relative Intensity
120.9848251	1.84
144.7615814	2.10
160.2162628	2.03
167.1559753	3.28
181.847168	9.94
189.1952515	2.32
207.1654053	1.54
208.0835266	5.71
218.9732666	2.38
257.204071	1.23
259.4157715	1.67
263.4650879	2.17
281.0922241	7.84
291.8740234	8.45
296.1758423	2.10
297.9914551	2.81
298.6096802	1.09
305.0883789	5.41
310.2041016	4.19
314.807373	7.74
322.3267822	1.67
324.1662598	3.06
326.2329712	1.52
332.1077576	3.83
336.2207642	2.32
337.0330505	7.70
338.0115051	7.78
339.3130493	18.00
340.1255493	2.46
346.3378906	2.48
352.271637	3.31
357.3442993	5.97
365.3475647	1.68
366.2471924	3.40
368.6435547	15.22
369.5229187	11.29
373.0005798	10.74
377.5469666	6.37
380.2562561	10.72
382.5372009	1.37
383.2901306	4.97
389.9809875	5.70
390.9564819	9.13
392.2802734	1.66
395.1895447	3.06
398.132843	10.60
406.2712708	4.68
407.6488342	26.33
408.2842712	100.00
409.2390747	25.11
417.2419739	2.53
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	569.2812
Annotation	Sedumoside A6
Peak:m/z	Relative Intensity
177.8249969	0.09
200.8186035	0.14
220.8857574	0.11
243.9424896	0.13
306.2218018	0.16
316.9259033	0.04
323.3091431	0.18
332.0377197	0.13
341.3977661	0.86
366.0753174	0.13
367.0265503	0.24
383.4915771	0.14
387.3262329	0.11
397.1773682	0.24
426.3707886	0.05
430.2932739	0.13
454.1691895	0.24
461.3916016	0.08
468.3420410	0.05
482.3103027	0.17
483.4178467	0.36
491.4260864	0.09
496.0863647	0.17
497.1515503	0.05
505.8003540	0.20
506.8174438	0.19
508.3587036	0.81
509.4392090	0.28
510.0446777	0.22
523.3180542	100.00
525.3580933	1.28
527.9848633	0.63
532.3392334	0.55
533.3244019	0.20
534.4292603	0.13
548.3505859	0.06
550.2272339	0.14
551.1580811	0.41
554.7025757	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	391.14
Annotation	Unknow
Peak:m/z	Relative Intensity
129.7906036	0.27
148.8908691	11.55
156.0920105	0.21
167.0307007	3.48
172.0997009	0.31
201.3337708	0.11
219.0256653	0.12
227.0716858	0.08
228.9710388	0.13
237.9369202	1.73
240.8975830	0.39
250.9378967	0.12
256.2633057	0.29
258.2952271	0.13
260.5454102	4.43
270.3218384	0.20
278.9976501	10.41
303.2382202	0.19
304.1531067	0.14
305.9886475	0.29
314.2900391	0.13
327.0658264	100.00
327.6996460	0.28
342.5690308	0.14
344.3578491	0.10
347.1044312	0.20
350.0557861	0.12
355.5834656	0.42
362.3153381	0.24
368.7662659	0.85
372.4036255	0.59
373.0503845	0.81
374.5343933	0.12
375.1919861	0.11
378.9104309	0.37
382.7369385	0.51
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	904.1111
Annotation	Unknow
Peak:m/z	Relative Intensity
298.4103088	0.16
356.3201904	0.37
504.3359375	0.16
557.0742798	0.10
568.5145874	0.48
604.2138062	0.13
638.5964355	0.35
651.6369629	0.54
689.3227539	1.01
695.1036987	0.22
729.6926880	0.15
736.5228271	0.44
737.2791138	0.14
742.6478882	0.23
785.0072021	0.53
820.9480591	1.13
833.2410889	0.74
840.3378296	0.26
843.4520264	1.35
844.4277954	0.23
860.9588013	2.50
867.4434204	0.31
868.8228760	0.17
872.4946289	0.70
873.9077759	0.20
877.0015259	0.92
877.8217163	0.33
879.4917603	1.44
881.0407104	0.96
883.3931885	12.08
885.7338257	0.63
891.5087280	1.57
892.9418335	3.37
932.7541504	0.13
949.1774292	0.57
955.7334595	0.16
957.0618286	0.30
959.5659180	0.11
963.3694458	0.40
966.4232788	0.12
967.8578491	0.47
968.6696777	0.12
970.6250610	2.88
983.9335327	2.40
989.6359253	0.12
992.1998901	2.77
993.5307007	0.11
994.1395874	0.20
996.1074219	1.40
997.8742065	0.23
999.0706177	1.43
999.9905396	0.50
1001.2891240	0.64
1003.3920900	1.09
1004.9385380	0.42
1006.1677860	0.26
1006.9230350	2.70
1008.2000120	3.87
1010.4915160	2.04
1011.5149540	14.94
1012.4196780	1.32
1013.5735470	6.39
1015.0271000	2.77
1016.1010130	43.66
1016.8381960	0.09
1018.0651250	0.92
1018.8170780	0.58
1019.7205200	6.10
1020.4184570	1.07
1022.3186650	3.64
1023.4888310	0.81
1025.2998050	6.18
1026.2022710	5.35
1027.4854740	50.88
1028.6839600	5.42
1030.5650630	100.00
1031.9248050	1.63
1032.6646730	2.73
1033.4853520	9.46
1034.3458250	5.03
1035.2657470	0.85
1036.6434330	0.73
1037.6015620	1.71
1038.5747070	0.94
1039.2009280	0.23
1041.2910160	0.32
1043.7854000	1.37
1046.5349120	0.28
1052.3408200	0.52
1055.2908940	0.17
1061.3366700	0.11
1072.4918210	1.08
1076.1522220	0.48
1080.9350590	1.14
1095.4760740	1.17
1096.2885740	0.19
1100.8317870	0.93
1109.1984860	0.45
1111.3728030	0.51
1116.6182860	0.46
1117.3673100	0.39
1126.7403560	1.90
1130.1921390	0.88
1132.8072510	0.71
1139.5922850	0.17
1140.1950680	0.24
1141.1983640	0.13
1142.8398440	1.21
1144.7056880	0.60
1145.6420900	1.03
1149.4750980	1.56
1154.6931150	0.26
1158.7419430	1.31
1160.5313720	0.99
1162.2814940	0.23
1163.0495610	1.44
1163.8193360	2.62
1171.1224370	0.38
1172.0080570	4.02
1172.7194820	2.12
1174.0712890	4.02
1175.9038090	1.19
1176.9818120	2.70
1178.5572510	2.11
1183.0718990	0.76
1185.2329100	0.79
1186.5920410	4.53
1189.4945070	5.61
1191.2314450	1.91
1192.6005860	1.30
1193.3093260	1.63
1194.1475830	1.77
1196.2623290	3.78
1196.9108890	1.53
1198.1342770	0.43
1198.9664310	0.37
1200.3642580	1.50
1201.6757810	1.86
1202.4655760	0.17
1203.3532710	6.16
1204.8255620	1.79
1206.9951170	6.53
1207.7285160	0.28
1210.2751460	4.31
1211.5855710	0.12
1212.5594480	1.18
1213.3112790	2.63
1214.0441890	2.40
1215.2611080	0.94
1216.8424070	4.09
1218.8527830	4.50
1220.5767820	1.18
1222.2613530	4.54
1223.3559570	1.01
1259.8182370	0.15
1271.8929440	0.73
1292.8430180	1.48
1302.0216060	1.59
1302.7369380	0.20
1307.8131100	0.24
1347.8763430	0.92
1387.0572510	0.90
1394.1013180	0.77
1401.7706300	0.22
1406.5502930	1.20
1420.5406490	0.87
1421.3378910	2.08
1427.6156010	0.30
1443.3587650	1.94
1463.1226810	0.91
1469.3347170	2.51
1474.9315190	0.54
1479.7783200	0.85
1507.0589600	0.91
1513.8583980	0.45
1520.9156490	0.38
1539.1973880	0.12
1539.9769290	0.11
1561.6892090	1.26
1564.5950930	0.76
1573.5718990	0.76
1579.9234620	1.29
1593.4310300	0.96
1602.7615970	0.16
1605.6107180	0.69
1625.0046390	1.23
1634.5852050	0.22
1640.9300540	0.49
1655.0726320	0.23
1722.0982670	0.57
1733.0399170	1.17
1742.9788820	0.18
1760.7684330	0.14
1766.8519290	0.89
1771.3211670	0.74
1774.3709720	0.38
1778.2076420	0.98
1793.4119870	1.64
1804.5709230	0.29
1805.6506350	0.15
1810.1383060	0.86
1829.8966060	0.24
1833.8732910	0.36
1843.1062010	0.28
1857.3804930	0.33
1864.1037600	0.21
1867.7414550	0.12
1879.0379640	0.19
1881.7655030	3.16
1892.9886470	0.25
1911.3258060	0.16
1936.4415280	0.17
1938.4846190	1.57
1944.5518800	0.13
1948.4356690	0.21
1952.1453860	0.32
1959.7071530	0.10
1968.9973140	0.98
1975.6544190	9.86
1983.1004640	1.04
1990.3734130	0.73
1995.4696040	0.35
1996.9937740	6.32
1999.2662350	3.52
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	259.0786
Annotation	4'-Hydroxyflurbiprofen
Peak:m/z	Relative Intensity
113.1674347	0.05
130.9823303	0.05
140.0130005	1.38
140.9551849	0.02
141.9860840	0.03
145.1120300	1.42
158.0181122	0.06
160.0301971	0.02
166.7884827	0.11
168.9278717	0.01
186.1320343	0.04
187.1124420	0.03
194.0927124	0.02
196.1092072	4.57
197.2681732	0.01
198.5008087	0.02
201.2722626	0.01
202.3428497	0.05
210.9714203	0.10
213.0525818	100.00
213.9643707	0.78
214.9862518	0.22
225.3019104	0.02
231.0645599	18.35
233.2244415	0.02
239.1587677	0.01
241.1242523	0.25
242.1291351	0.25
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	459.2152
Annotation	Unknow
Peak:m/z	Relative Intensity
145.0127106	0.04
151.2547607	0.02
153.0286255	0.18
162.7832336	0.03
165.0740509	2.20
165.7683868	0.02
167.0610199	1.42
176.9683380	0.20
185.0254669	1.53
186.1914368	0.03
197.0570068	0.08
202.1501923	0.04
203.0291901	0.05
204.7307129	0.31
211.0511932	0.03
213.1349182	0.03
217.2907104	0.25
219.9645996	0.03
227.3812714	0.04
239.2380371	0.09
240.2980042	0.03
245.2031860	0.02
247.2619019	2.31
256.1871338	0.07
261.1255188	0.07
273.2653503	4.43
289.8150940	0.18
291.2618103	100.00
298.3509827	0.06
313.6354065	0.08
323.3364258	0.06
325.3763428	0.04
327.4864197	0.08
339.3110352	0.05
341.2625122	0.11
341.9652100	0.07
347.2545471	0.14
349.1869812	0.08
374.2682800	0.08
379.5591736	0.03
383.2930603	0.11
386.3516846	0.07
387.3153076	0.03
390.0602112	0.20
394.2666321	0.02
412.4522705	0.28
413.3354187	0.68
415.1844788	0.68
416.2962646	0.03
420.1724548	0.05
421.2204895	0.15
422.3059082	0.14
423.3703308	0.10
427.4246521	0.04
428.6249084	0.10
440.3506165	0.29
441.4922180	0.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	251.07
Annotation	7-Hydroxy-3-Methylflavone
Peak:m/z	Relative Intensity
82.85736847	5.45
96.99308777	16.75
111.0406494	5.63
123.0861969	3.12
123.7318726	2.03
150.9991455	10.95
152.8672028	3.48
159.9322052	2.03
165.4444733	1.84
173.9044495	3.31
181.0099792	3.32
183.2327118	4.21
187.2238312	3.85
188.0790253	4.37
189.2299957	2.39
192.2361755	2.57
194.2991791	3.30
195.1738434	31.48
205.284317	4.58
206.1230316	4.47
207.5290222	9.77
208.2731476	1.48
209.2852936	45.05
214.8718567	12.19
217.059082	4.93
223.1168823	39.73
230.9470367	12.02
233.1781769	68.69
235.2071686	4.58
251.0692902	100.00
252.1414795	17.56
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	659.7104
Annotation	Unknow
Peak:m/z	Relative Intensity
186.9051056	0.20
226.1732483	0.21
227.2040253	0.06
230.3006592	0.35
236.6751709	0.09
245.8190002	0.79
259.2053528	0.07
270.8359070	0.20
272.9841309	0.17
280.2948914	0.28
283.9903564	0.13
284.8581848	0.14
290.2432556	2.18
291.5259094	0.16
301.4190674	0.18
333.2499390	0.07
338.8383789	0.19
342.3925171	0.09
371.3980713	0.07
372.0311890	0.36
373.5231323	0.08
380.3873291	0.80
385.2914429	0.06
386.5025635	0.40
388.3477173	0.19
389.4758301	1.00
391.2712402	8.82
392.2803955	0.57
393.3137207	0.45
407.2895508	1.64
412.4011230	0.08
415.9675293	0.71
424.6479492	0.55
426.5563965	0.12
428.8637695	0.13
432.4635620	0.15
449.0167847	0.46
451.9468994	0.24
457.4184570	0.29
466.1341553	0.32
466.9830322	0.50
467.9910278	0.23
472.4718018	0.15
475.1448364	0.36
478.0637207	0.11
479.4819336	0.25
482.4852905	0.28
488.4629517	0.15
490.3653564	8.23
491.2519531	2.01
491.8808594	0.57
492.5679932	0.40
498.1580200	0.08
499.6818848	0.46
506.8361206	0.22
510.1853638	0.63
513.0361938	0.10
524.0247192	0.12
529.2080688	0.19
535.6200562	1.01
537.8546753	0.11
539.8551025	2.92
540.5617676	0.80
543.0784912	0.23
543.8832397	1.80
545.9962769	0.31
548.7350464	0.44
550.8657227	0.49
553.4042358	0.39
561.4366455	0.43
563.5506592	0.20
565.7764282	0.48
571.9918213	0.37
573.4549561	0.27
575.4653931	1.14
576.4561157	0.15
577.9935913	0.67
578.6727905	1.19
581.2055664	0.85
582.1145630	0.90
583.1715088	0.57
583.8536987	0.07
585.8347778	0.37
590.4960938	0.14
595.8958130	0.67
597.3850098	0.45
599.4597778	0.09
601.3213501	3.10
603.8711548	2.81
605.3761597	6.03
606.0130615	0.13
607.1000366	1.14
608.1917725	1.92
608.8444214	1.48
609.9318237	0.68
610.7023926	0.82
611.3402710	0.66
613.0189819	0.69
615.1837769	0.52
616.5617065	0.33
619.4779663	4.75
620.4726562	2.71
621.4183960	0.26
622.9642334	1.29
624.0404663	0.98
626.0993042	10.57
627.5998535	0.34
628.5705566	0.21
630.7153320	7.70
631.9246216	0.43
633.1757812	0.23
633.9785767	1.08
636.1238403	2.30
636.7689819	0.14
637.9078369	0.62
639.3580322	0.91
640.6007690	0.75
641.3712769	0.39
642.0875244	0.63
643.1168823	1.54
644.3862915	4.46
645.3688965	3.37
646.0758057	2.62
646.8531494	3.28
647.7413940	7.17
648.6992188	1.58
649.3434448	25.47
650.2175903	0.95
651.4287720	7.35
652.6588135	1.16
659.7343140	0.25
665.7503662	5.13
670.8299561	0.90
674.1229248	0.57
674.9425659	0.47
676.4491577	7.39
677.6921997	1.93
681.8050537	0.15
682.6392822	0.32
684.6973877	0.42
686.0718994	0.09
686.7128906	0.18
687.7734375	0.45
689.0044556	1.08
689.6669922	0.76
691.2252808	3.37
693.2616577	3.29
693.9500122	0.97
694.6302490	0.19
695.9747925	0.18
698.0901489	30.32
701.1720581	0.10
702.4215698	10.06
703.8003540	0.28
705.9835815	0.23
706.8607178	0.82
709.5236206	1.14
710.3666992	0.39
712.5092163	0.41
713.9365845	0.29
718.4986572	4.03
719.4443970	1.70
720.1664429	0.65
721.3804321	0.72
722.8621216	4.72
723.6463623	0.85
725.0673218	2.44
726.1460571	0.44
727.2555542	19.05
728.1477051	1.07
729.5730591	0.62
731.5854492	0.15
733.0117798	1.75
733.8881226	1.31
743.6204224	0.65
745.2960815	0.33
747.9107056	1.87
750.8552246	0.41
752.3963013	11.23
753.0012207	8.14
754.0978394	5.51
755.0017090	0.95
755.9865112	0.48
756.9677124	0.62
759.6916504	0.52
760.7621460	0.52
761.4442749	0.56
763.7713013	0.38
765.3431396	0.16
766.2701416	0.06
768.6293945	0.85
769.4688110	0.13
770.9638062	1.28
771.9841919	0.33
772.6200562	2.57
773.3626099	0.47
776.8930054	4.89
777.5218506	4.67
778.5509033	0.90
779.3999023	0.21
783.2805176	2.20
785.0258789	0.34
786.6715088	0.55
787.8081665	0.63
788.8637085	0.29
791.1664429	0.53
792.6258545	0.82
793.8021851	0.42
799.4673462	0.53
803.7282104	0.99
804.8212280	2.98
805.4716187	1.69
807.4414062	1.45
808.3663940	1.18
809.9110107	0.42
810.7677612	4.36
811.4475708	2.22
812.4560547	0.06
816.7648926	3.42
817.5600586	0.83
818.4734497	0.49
821.8644409	1.48
822.7293091	2.32
825.1266479	0.37
830.4558716	1.85
831.9586792	0.43
832.8734741	0.30
834.5910034	4.30
835.3884888	0.13
836.5582886	0.21
839.0509644	0.37
840.5268555	18.01
841.5891113	1.95
844.4745483	0.14
848.5939331	1.59
849.8543091	0.63
856.2715454	0.41
859.6369629	1.56
861.2265015	0.47
862.6253052	2.29
863.5155640	0.40
864.4313354	0.48
868.3837891	2.29
874.2026367	11.31
875.0947266	0.52
875.8405151	0.16
877.8189087	0.18
881.7249146	0.78
887.0972290	0.80
893.1608887	3.41
893.9442749	0.40
897.5305786	0.56
898.8274536	0.20
902.5283203	0.22
912.6144409	0.06
913.8354492	0.14
914.6516113	0.68
916.5357056	0.19
924.2584839	4.20
924.9629517	0.32
927.1113281	0.09
930.2937012	4.49
931.1527710	0.57
931.7893677	0.39
932.8283081	0.23
933.6798706	0.54
936.2102051	11.34
937.4926147	0.50
940.3454590	0.12
942.3869019	0.38
948.9057617	0.09
951.2499390	0.30
969.0407715	0.93
969.9341431	0.56
983.6741333	0.07
987.8577271	0.29
995.2426147	0.46
1000.7913210	0.30
1019.1586910	0.24
1027.1273190	0.16
1037.0764160	0.50
1038.7410890	0.16
1044.7200930	0.06
1048.5828860	0.37
1062.8806150	0.60
1078.0732420	0.20
1081.3342290	0.18
1082.6352540	0.22
1087.5764160	0.30
1093.4620360	0.11
1102.7095950	0.09
1119.3524170	0.17
1122.0594480	0.14
1130.3940430	0.28
1160.9943850	0.17
1170.5920410	0.17
1174.6071780	0.53
1180.3189700	0.36
1190.4722900	0.20
1207.8775630	0.16
1211.3170170	0.20
1216.6083980	0.10
1217.8541260	0.20
1247.3049320	0.15
1255.2309570	0.20
1263.4166260	0.12
1273.2343750	0.26
1323.6195070	0.08
1345.6793210	0.26
1346.6026610	0.17
1347.2668460	0.17
1368.8956300	0.14
1417.7410890	0.43
1418.8284910	0.73
1443.7752690	0.10
1491.9539790	0.09
1532.0455320	0.15
1697.2326660	0.15
1729.9544680	0.20
1758.6077880	0.06
1766.5246580	0.37
1773.3658450	0.08
1793.0504150	0.94
1799.8436280	0.18
1810.9470210	0.09
1815.7864990	3.45
1838.9991460	0.20
1848.0457760	0.08
1852.9757080	1.74
1856.4967040	17.59
1863.1960450	0.06
1864.2615970	0.87
1870.5294190	3.50
1886.4256590	0.70
1889.9263920	0.12
1890.6326900	2.19
1894.3610840	4.07
1899.8690190	1.11
1901.0255130	0.08
1902.8516850	0.56
1909.3889160	0.54
1910.9119870	1.57
1912.0809330	54.47
1919.5593260	0.71
1921.9273680	0.31
1923.7593990	0.31
1924.4305420	100.00
1926.1368410	0.30
1927.8372800	0.34
1932.0057370	0.90
1933.9063720	2.16
1935.7252200	0.56
1939.3963620	0.24
1941.5230710	1.96
1942.9974370	0.16
1943.6774900	6.05
1945.5665280	0.12
1947.7991940	0.06
1949.4249270	0.07
1951.2283940	0.20
1955.9582520	0.17
1957.5531010	0.34
1959.4382320	1.28
1960.7883300	0.06
1961.4813230	0.05
1963.2386470	0.06
1964.0015870	0.61
1964.7178960	0.91
1966.0870360	0.11
1968.2418210	28.27
1969.6502690	0.55
1970.3399660	11.01
1973.2019040	22.26
1974.8205570	0.08
1978.7088620	2.14
1981.2864990	0.41
1982.1276860	0.54
1985.8571780	0.24
1986.6612550	0.21
1987.5145260	0.51
1988.3968510	0.08
1990.1896970	1.00
1991.4605710	1.82
1992.7565920	6.22
1994.4437260	0.05
1997.1693120	1.86
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	464.73
Annotation	Unknow
Peak:m/z	Relative Intensity
194.1410980	0.27
229.1416931	0.22
232.1651611	0.39
232.9535065	0.11
252.1498108	0.13
292.6917114	0.36
296.7590942	0.27
300.9591675	0.41
318.8447266	0.09
326.1276550	0.42
328.2151184	0.31
365.2330627	0.20
380.7143250	100.00
381.3999634	0.55
397.0393982	0.35
446.3719482	1.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	370.0205
Annotation	Unknow
Peak:m/z	Relative Intensity
134.8479156	0.02
144.8405151	0.01
169.3179779	0.05
174.9004822	0.21
177.0710449	0.07
183.2654724	0.05
187.0888214	0.01
192.1930847	0.05
202.9589844	0.15
207.0591736	0.03
210.4561462	0.03
225.2954407	0.09
231.2984009	0.02
238.9195557	0.02
240.0877686	0.02
241.0263977	0.12
254.1923218	0.38
256.7875366	0.02
257.5686340	0.05
263.0103760	0.02
268.0992432	0.03
269.6596680	0.01
272.1904297	3.49
279.2761841	0.05
281.0154114	0.02
285.0599976	0.04
286.0676880	0.57
288.1032715	0.47
289.2313232	0.16
294.9967651	0.03
299.1504517	0.02
302.2232361	0.02
304.1862183	10.25
306.1390686	100.00
307.2221680	0.09
310.4496765	0.03
316.2260437	0.01
318.0133667	0.18
323.3170166	0.07
324.0135803	0.11
325.1905518	0.45
325.9620972	0.10
331.2859802	0.08
333.1673584	0.13
334.2176819	0.01
336.1413879	6.36
349.1820984	0.01
351.3442383	0.19
352.0879822	0.19
353.2938538	0.04
355.3176575	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	298.11
Annotation	7-Methylguanosine
Peak:m/z	Relative Intensity
79.05396271	0.14
100.9118042	0.12
109.9743881	1.73
118.9125214	2.48
135.9408875	1.58
138.9880981	0.22
153.8406372	0.41
156.0387268	1.55
166.0731354	100.00
167.0349426	0.55
174.1586304	0.08
180.0949097	0.26
181.9813843	0.08
183.0555115	0.13
199.2267761	0.13
208.0676575	0.09
231.8889465	0.74
233.5061951	0.37
234.1567688	0.32
237.2549133	0.14
238.4406738	0.06
240.3104858	0.19
244.1480408	0.08
251.1631775	0.34
252.2069702	6.01
253.0496216	0.19
255.2054443	0.17
257.1073914	0.34
261.9993286	0.41
263.1280823	0.06
267.0907593	0.07
277.7840881	0.13
279.4515381	3.48
280.2132568	11.34
281.0718079	1.19
282.2622375	1.06
288.5363159	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	518.9
Annotation	Unknow
Peak:m/z	Relative Intensity
159.0828857	0.67
159.9921722	0.23
160.9873505	0.33
175.0651550	1.79
176.0976868	0.38
176.9494934	0.03
198.9449615	0.26
199.9271240	0.03
201.0537109	0.18
214.7461090	0.03
229.1765747	0.03
229.9899445	0.09
231.0917969	0.02
233.3238983	0.03
245.0290070	0.24
245.9961090	0.04
247.0928040	0.11
272.9834595	5.22
274.0327759	7.40
275.0148926	5.23
288.9948120	15.52
289.9603882	6.45
291.0905151	5.04
329.1013184	0.04
360.0559082	0.11
387.9859009	0.32
388.9406738	0.58
402.9799805	77.69
403.9595337	100.00
404.9121094	89.33
445.1594238	0.24
471.7614746	0.30
472.9010620	0.16
473.8670044	0.25
475.0794067	0.18
501.1686401	0.03
509.1199341	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	579.2082
Annotation	Stecholide L
Peak:m/z	Relative Intensity
181.0366364	0.11
224.9319458	0.05
243.2534485	0.03
261.1959839	0.07
271.5226440	0.17
272.2225647	0.06
273.1540527	0.12
277.4273682	0.02
306.0145569	0.20
307.0176392	0.24
310.0359497	0.16
322.9338379	0.05
338.3896484	0.02
342.4262695	0.04
343.1676025	0.06
344.2352295	0.08
347.1106567	0.06
353.3306274	0.05
357.0852661	0.07
371.2614746	0.06
373.4169922	0.08
389.8642578	0.03
414.1286011	0.02
415.4332275	0.08
417.2125854	100.00
417.8461914	0.30
420.2184448	0.07
432.5645752	0.02
444.9374390	0.03
449.5856934	0.13
451.0709839	0.05
452.9317627	0.03
455.3646240	0.10
456.5662842	0.02
482.8158569	0.04
483.6950073	0.03
488.8079224	0.11
491.3628540	0.04
493.3061523	0.40
501.3722534	0.03
503.0363159	0.02
505.2475586	0.05
505.8978882	0.09
509.6848755	0.02
514.4306030	0.06
515.3482056	0.04
518.5114136	0.16
519.3007202	0.22
520.2262573	0.02
523.1813965	0.10
525.6047974	0.15
532.3759155	0.24
533.1989746	1.00
534.3638306	0.02
535.3696899	0.47
536.8847656	0.12
540.1928101	0.03
542.3993530	0.08
543.5769653	0.04
545.3358765	0.02
559.9791870	0.06
561.5048828	0.47
579.3307495	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1139.1503
Annotation	Unknow
Peak:m/z	Relative Intensity
308.1208801	0.10
328.9135742	0.08
340.3784180	0.11
405.4573364	0.47
424.7208252	0.07
425.3246460	0.37
511.4349976	0.11
518.2344971	0.22
536.1422119	0.42
552.4241943	0.16
557.5186157	0.25
571.1724854	0.13
580.2609863	0.24
614.6842041	0.58
617.4434204	0.07
626.7354736	0.18
629.2132568	0.79
642.3541260	0.14
655.8812866	0.42
658.9557495	0.10
700.9542236	0.25
711.2083740	0.15
717.0053101	0.21
729.8138428	0.35
738.3989258	0.09
748.3590088	0.13
766.2044678	0.39
778.9705811	0.17
810.6408691	0.29
813.6495361	0.14
829.1478271	0.25
844.6759033	0.04
862.7766113	0.17
879.3422852	0.25
898.6457520	0.25
917.6994629	0.34
932.5761719	0.11
951.5048828	0.44
964.2336426	0.17
972.5468750	0.09
985.1281738	0.30
994.2478027	0.25
1000.1892090	0.64
1003.8271480	0.48
1029.2886960	0.43
1030.6828610	0.99
1031.7814940	0.80
1042.1481930	0.44
1048.2468260	0.07
1053.1423340	2.05
1063.8836670	0.08
1064.9959720	0.33
1066.4781490	0.10
1068.6456300	0.57
1073.9047850	0.15
1074.5122070	0.19
1077.7939450	2.08
1078.4373780	0.82
1080.6934810	3.00
1081.7199710	2.50
1082.3945310	2.57
1084.5081790	1.03
1086.2152100	0.62
1086.9321290	1.84
1088.9620360	0.19
1090.2661130	2.77
1091.5791020	2.13
1092.6533200	0.93
1093.7493900	2.49
1094.3999020	0.90
1095.0706790	1.31
1095.9649660	4.59
1097.2180180	1.08
1099.2576900	6.04
1100.2143550	1.35
1101.3613280	2.99
1102.1362300	7.69
1104.3444820	1.76
1105.5161130	2.32
1106.3127440	1.98
1108.1156010	0.61
1109.5034180	5.05
1110.7769780	0.07
1112.2617190	10.73
1113.1907960	0.71
1114.1558840	0.80
1115.2985840	44.31
1116.3496090	0.39
1117.9274900	5.86
1118.7570800	4.29
1119.5239260	4.20
1120.6337890	2.85
1121.7854000	0.67
1122.5645750	3.55
1123.3937990	1.70
1124.2144780	0.78
1125.1002200	1.66
1126.1998290	1.38
1127.4765620	3.91
1128.3947750	0.87
1129.0563960	0.48
1159.5645750	0.09
1170.4980470	1.06
1172.9511720	0.22
1173.5656740	0.47
1176.2602540	0.46
1182.8458250	0.76
1184.4200440	1.08
1185.3759770	0.24
1187.3916020	0.32
1191.4553220	1.20
1194.0187990	0.47
1196.1029050	1.12
1198.3067630	0.71
1199.9348140	1.35
1203.0628660	0.43
1205.3194580	0.67
1206.0187990	0.74
1206.8037110	0.80
1211.2846680	0.84
1213.8833010	1.08
1218.7760010	1.13
1219.4445800	0.61
1220.6995850	0.88
1221.8073730	2.46
1222.4270020	1.81
1225.5246580	0.26
1227.1582030	0.68
1227.8725590	1.23
1228.4787600	1.30
1230.1953120	0.37
1233.0075680	1.43
1233.9530030	0.12
1235.6140140	0.65
1236.2152100	0.83
1237.3229980	2.06
1237.9406740	0.86
1240.5751950	1.39
1242.9184570	1.03
1243.6647950	1.62
1246.4818120	0.93
1247.0896000	0.44
1249.2888180	2.38
1249.9833980	1.24
1251.4538570	1.07
1255.3415530	2.23
1256.5668950	0.66
1258.9886470	0.31
1261.0540770	4.04
1263.7764890	1.26
1265.0380860	4.17
1265.8854980	0.83
1267.1098630	1.25
1268.2039790	2.85
1270.5363770	2.76
1271.9807130	5.54
1273.2188720	0.98
1274.1870120	2.19
1274.9608150	2.34
1275.6273190	3.20
1276.9187010	0.50
1277.9632570	0.14
1278.8830570	3.99
1279.7132570	0.92
1281.2587890	3.89
1282.5163570	0.96
1284.9941410	1.61
1285.8417970	0.35
1286.4536130	1.10
1287.5355220	0.50
1289.1242680	5.76
1291.3619380	1.58
1292.1860350	0.75
1293.0827640	3.01
1293.9660640	4.80
1294.8698730	4.02
1295.8215330	1.44
1297.0939940	2.75
1297.7783200	0.96
1298.5234380	0.29
1299.2530520	0.83
1300.5460210	3.09
1301.5393070	6.11
1302.3367920	2.06
1303.7106930	3.77
1304.8067630	2.43
1306.3524170	2.34
1307.4572750	4.35
1308.5677490	1.23
1309.9919430	3.55
1310.6257320	0.72
1311.7875980	7.90
1312.7697750	2.53
1313.4746090	1.86
1314.8162840	4.79
1315.5041500	7.05
1316.5059810	3.56
1317.7932130	3.40
1318.7778320	4.87
1320.3214110	1.62
1321.1833500	2.54
1322.1458740	1.54
1323.9096680	3.63
1324.8182370	5.88
1325.5046390	0.05
1326.7598880	4.32
1327.5133060	6.07
1328.3665770	1.02
1329.0727540	1.21
1330.4022220	6.34
1331.1810300	11.64
1332.5098880	3.94
1333.3233640	1.82
1334.4090580	25.22
1335.2890620	1.91
1336.5800780	1.52
1338.0367430	100.00
1339.1990970	0.43
1340.9270020	6.84
1341.9307860	7.43
1342.7188720	2.26
1344.0114750	3.21
1345.0289310	3.60
1345.8562010	0.39
1347.4346920	4.47
1349.8790280	1.77
1353.1751710	0.12
1358.3265380	1.17
1359.2545170	0.12
1360.0665280	1.29
1361.4312740	1.43
1364.1031490	1.35
1365.5898440	2.04
1366.6807860	0.35
1369.9605710	0.10
1372.7326660	0.81
1373.4661870	0.05
1377.8031010	0.19
1379.2495120	0.18
1382.2974850	0.62
1383.7946780	0.43
1388.7794190	1.78
1391.2774660	0.53
1398.2105710	1.16
1400.9613040	0.16
1402.0195310	0.93
1410.1373290	0.40
1411.3280030	1.08
1414.2384030	0.82
1414.8775630	0.64
1417.2364500	1.21
1423.7060550	0.29
1431.4830320	1.17
1433.4364010	0.58
1434.5083010	0.98
1436.5172120	0.41
1443.0462650	0.86
1443.6789550	0.87
1447.9969480	1.39
1449.0428470	1.15
1450.1179200	0.76
1457.8775630	0.93
1458.7603760	0.54
1460.0457760	0.51
1465.1617430	0.08
1465.8590090	0.37
1466.9693600	0.40
1470.4191890	0.76
1474.0345460	0.66
1479.3111570	0.53
1480.0372310	0.57
1485.9947510	0.78
1486.8209230	0.67
1489.1444090	2.15
1493.8990480	1.43
1497.9183350	0.57
1501.4589840	0.08
1502.8071290	0.44
1510.8553470	0.55
1512.4581300	0.71
1514.4312740	1.13
1515.3973390	0.24
1519.7371830	0.56
1520.7701420	0.95
1521.7269290	0.35
1522.4851070	1.35
1525.0318600	0.96
1526.1280520	1.14
1529.9429930	0.60
1531.3607180	1.01
1532.8538820	0.18
1533.9515380	0.10
1541.2435300	0.73
1542.4025880	0.61
1544.3397220	0.85
1545.2917480	0.81
1547.0375980	0.61
1548.7171630	0.63
1550.4173580	0.79
1551.7766110	0.64
1553.1784670	0.51
1557.7567140	2.19
1559.1063230	0.48
1561.5609130	0.53
1566.4591060	0.72
1567.3415530	0.72
1569.1761470	0.86
1570.2261960	0.95
1572.5482180	1.31
1575.7779540	0.38
1576.9230960	1.86
1577.7452390	1.53
1578.5517580	0.68
1579.4467770	0.99
1580.3519290	0.46
1582.1798100	1.52
1582.8499760	1.53
1583.9766850	1.44
1585.3087160	0.38
1585.9837650	1.01
1589.1175540	1.64
1589.8709720	0.64
1591.0465090	0.30
1592.7723390	0.21
1593.6518550	0.72
1594.2999270	0.76
1598.2713620	0.99
1599.5295410	1.52
1607.4952390	1.30
1611.4608150	0.77
1613.1500240	0.65
1615.3933110	0.47
1620.9962160	0.73
1621.8925780	0.48
1624.2338870	1.26
1627.8864750	0.09
1629.7049560	0.37
1636.0250240	2.46
1637.7280270	1.56
1639.0963130	0.46
1642.7714840	2.29
1647.2061770	0.33
1648.2711180	0.33
1652.4654540	0.61
1658.4117430	0.50
1666.4689940	0.73
1680.0062260	0.38
1688.5177000	0.12
1696.5457760	0.36
1738.7938230	0.19
1740.7825930	0.40
1743.9942630	1.04
1762.5997310	0.44
1794.2633060	0.47
1794.8991700	18.38
1807.5388180	0.05
1809.8728030	0.12
1812.6446530	0.06
1863.8991700	1.45
1873.4002690	0.51
1878.1125490	3.22
1885.9992680	0.10
1894.5799560	0.06
1902.3765870	0.91
1904.3709720	0.07
1910.8751220	0.07
1931.3576660	0.96
1947.5157470	0.63
1961.4364010	1.14
1963.8336180	2.04
1967.9005130	0.35
1975.8218990	1.26
1977.1951900	11.37
1979.9583740	2.25
1986.4919430	0.17
1987.6794430	0.06
1992.9503170	0.33
1999.9766850	2.93
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	345.2266
Annotation	Gallicynoic acid F
Peak:m/z	Relative Intensity
126.9673233	3.14
145.0890961	1.02
150.8294373	1.40
152.8275146	0.53
183.1143646	9.90
212.9931641	1.72
216.7063293	1.50
237.2207642	0.36
278.8593750	100.00
279.5010071	0.36
284.4185181	0.71
296.2535400	1.77
309.2732544	8.14
310.3572998	1.09
327.1617126	16.32
328.2871704	0.75
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	244.0615
Annotation	Haplopine
Peak:m/z	Relative Intensity
70.8996429	0.72
72.7730026	0.87
74.8888855	0.13
82.7962799	0.21
85.9303207	0.08
87.0599823	1.01
98.7059936	0.53
108.9653168	0.11
112.9554138	0.59
114.0211487	2.16
114.8981171	94.08
115.9615326	25.36
126.9336700	0.15
128.1178894	0.07
130.0668030	0.94
141.9801178	1.39
143.9853058	97.48
144.9699554	0.22
154.0881500	5.30
156.0649109	5.51
158.0501556	4.50
159.0175323	0.09
160.1173553	0.59
169.0711060	0.25
170.0590668	3.52
172.1396942	99.74
173.1572723	0.32
173.9392548	0.16
175.1455536	0.14
180.0427094	0.31
181.0196075	0.39
182.0366516	21.86
183.0681000	0.22
184.2016449	0.07
185.9690704	100.00
188.1347504	21.24
196.0411530	0.10
198.0963898	24.91
200.1236725	47.32
201.0694122	1.32
202.1407776	0.11
208.2654266	0.11
214.1608276	1.95
216.0881653	14.01
225.2659760	3.09
226.0744171	14.84
228.0808563	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	562.3148
Annotation	Unknow
Peak:m/z	Relative Intensity
232.0029297	0.03
242.2007446	0.05
277.3618774	2.51
283.2765503	0.02
286.3587646	0.02
339.2622070	0.03
341.5622559	0.02
347.1379395	0.04
349.2930908	0.02
363.3519897	0.01
380.2221069	0.09
393.6593018	0.04
412.2454834	0.06
431.1862793	0.08
432.3098755	0.02
457.3273926	0.04
466.2871094	0.02
476.5928955	0.06
481.6181030	0.03
488.3828125	0.03
494.2337036	0.03
502.3021240	100.00
503.3652954	0.37
506.3217773	0.02
515.3837891	0.04
516.0679932	0.02
516.9049683	0.03
524.4341431	0.13
525.8023071	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	158.08
Annotation	Tiglylglycine
Peak:m/z	Relative Intensity
69.9661713	0.44
86.0392761	0.14
102.0265961	0.09
106.9449463	0.15
111.8644867	62.88
112.7174683	0.06
116.0534668	1.42
116.9540558	1.98
130.1498566	0.32
139.9941711	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	191.0197
Annotation	Diketogulonic acid
Peak:m/z	Relative Intensity
56.8283043	0.11
85.0409546	0.45
86.9604950	1.12
110.9030304	100.00
111.8320770	0.08
129.0020447	2.56
130.8587341	1.05
146.7531281	0.03
155.0066071	0.31
172.9119873	22.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	465.0338
Annotation	Unknow
Peak:m/z	Relative Intensity
134.9554901	0.12
137.0213013	0.64
138.0788422	0.05
139.1486359	0.12
153.0264282	0.05
159.0116425	0.02
161.1656036	0.03
164.9048309	0.17
195.1308289	0.24
196.0102997	0.05
208.9885406	0.01
217.0489807	0.11
218.1584625	0.05
221.2695923	0.05
222.9831848	0.14
235.8204651	0.03
237.1675110	0.02
241.0567017	11.14
242.0567017	1.63
246.5849304	0.02
247.2016907	0.07
253.1129456	0.03
257.3931885	0.03
259.1946716	0.04
275.1183472	0.02
281.0869141	0.06
283.0750732	100.00
284.0806274	15.05
285.4684143	0.03
301.0969238	0.11
302.2615051	0.02
304.0167847	0.07
309.1662598	1.96
310.1605225	0.15
317.3253479	0.02
319.9648743	0.02
324.2973633	0.04
327.0590820	77.50
328.1496582	12.19
335.0797424	0.04
341.1647949	0.92
342.3505249	0.04
343.3748474	0.03
344.4017944	0.04
345.1989136	0.11
361.2261353	1.29
362.1363220	0.27
368.0202026	0.04
377.2434082	0.36
379.0552368	7.63
380.1651917	1.83
385.3402710	0.09
386.1947021	0.09
405.0408325	0.02
419.2947693	0.10
421.1238098	31.45
422.1334534	8.04
424.0196838	0.06
427.4943848	0.06
429.2004395	0.05
433.1690979	0.06
435.3044739	0.02
436.3902283	0.05
436.9974060	0.05
440.7867432	0.02
445.1232605	0.08
447.1532898	2.62
448.1561584	0.90
450.2834167	0.05
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
209.1710205	0.02
222.0296783	0.06
222.9124603	0.09
224.0342865	11.17
224.8980103	100.00
242.0246124	4.31
242.8727417	14.26
244.5226440	0.17
265.6799927	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	455.1132
Annotation	Mulberrofuran R
Peak:m/z	Relative Intensity
144.1576080	0.17
144.8593140	0.05
145.9819641	1.14
171.9967804	0.82
173.0266571	0.06
189.0614624	0.09
190.1206665	0.26
197.1638794	0.19
199.0592041	0.11
212.9066010	0.06
215.1263275	25.58
225.0527954	0.04
231.2350922	0.11
241.1631165	0.33
242.2720642	0.02
243.0584564	0.09
253.2750244	0.03
257.4882507	0.10
259.0932312	2.81
261.1060791	0.08
263.1923218	0.04
272.2239075	0.11
274.4312744	0.29
275.0937500	0.04
281.0998535	0.10
293.1506348	4.44
298.4791870	0.03
301.1466064	0.21
301.7684631	0.09
309.3087158	0.16
321.3477783	0.04
322.5668945	0.04
325.1424255	0.05
326.0390320	0.04
334.1724854	2.35
336.9541016	0.14
338.2196045	0.06
339.3115845	0.52
340.3487549	0.34
343.1514893	0.07
347.0645752	0.11
352.2121887	0.61
358.2894287	0.05
361.4013672	0.04
367.1300659	0.14
368.2153015	0.29
374.6057434	0.05
375.2193909	0.15
377.2556152	29.94
378.1728821	0.07
387.6098328	0.04
392.4486694	0.06
393.2462463	0.04
395.2641602	0.09
403.2942200	0.97
409.3095398	0.45
411.4080505	0.10
412.1195984	0.10
415.3877258	0.09
418.8403015	0.02
421.1771545	100.00
436.2522583	0.68
437.3898926	0.42
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	993.1838
Annotation	Unknow
Peak:m/z	Relative Intensity
325.2209167	0.19
353.0236816	0.07
359.3380737	1.20
360.6289062	0.07
384.4647827	0.10
399.3970642	0.08
454.9314270	0.08
522.4082031	0.44
539.2802734	0.11
549.6688232	0.12
584.3488770	0.10
589.1308594	0.15
601.3095703	0.14
602.5057373	0.79
616.5246582	0.30
619.4308472	26.81
620.4467773	6.93
621.3977051	0.76
622.0183716	0.02
626.2917480	0.11
666.4259033	0.11
672.3730469	0.28
702.4123535	0.51
707.8294678	0.10
714.0775757	0.29
714.8546143	0.06
715.5627441	0.50
728.4155273	0.15
732.4554443	7.33
733.4790039	2.74
734.5603027	0.63
735.1718750	0.13
743.4021606	0.07
765.1860352	0.35
779.4045410	1.22
812.0780029	0.36
821.0617676	0.35
826.4838867	0.09
828.6453857	0.17
829.8278809	0.77
845.5286865	2.63
846.7497559	1.14
856.1008301	1.55
857.5465088	0.33
865.2838135	0.71
865.9342041	1.47
887.4637451	0.08
898.7319336	0.18
899.6715088	0.19
906.8959961	0.16
916.8518066	0.20
924.5952148	0.06
929.1746826	3.82
930.0712891	0.56
955.8154297	0.16
958.4575195	0.63
959.4484863	0.41
960.6955566	0.08
964.8037109	0.24
966.6716309	0.08
973.3540039	0.15
978.1357422	0.14
997.5107422	0.31
1001.7414550	0.47
1003.1860350	0.88
1010.6776120	0.41
1011.6201170	0.21
1032.4727780	0.05
1041.0373540	0.41
1067.3804930	6.58
1068.1015620	4.47
1068.7939450	0.16
1072.8083500	0.27
1100.8649900	0.14
1110.3071290	0.07
1114.7825930	1.26
1121.9213870	0.40
1123.6760250	9.23
1124.3743900	18.76
1125.2478030	0.78
1125.9747310	0.33
1126.7014160	0.15
1146.5438230	0.31
1147.6458740	0.06
1148.7402340	0.10
1166.0570070	0.16
1167.0921630	1.34
1167.8691410	0.39
1171.4836430	0.48
1172.0876460	0.73
1172.8457030	0.24
1180.4638670	100.00
1181.4144290	28.12
1182.6439210	0.20
1183.5383300	0.22
1184.3862300	0.39
1185.0233150	0.06
1200.2628170	0.15
1214.1063230	0.28
1215.7370610	0.23
1228.6953120	0.06
1229.4152830	0.10
1230.0260010	0.11
1233.1850590	0.07
1249.6130370	0.34
1250.7318120	1.33
1278.6500240	0.65
1284.9208980	0.07
1310.5701900	11.81
1311.2934570	6.82
1312.1265870	0.10
1320.9272460	0.11
1321.8956300	0.43
1342.7366940	0.31
1345.1390380	0.62
1345.8396000	0.34
1354.1727290	2.87
1355.0046390	0.85
1365.4941410	0.21
1456.9243160	0.08
1457.9952390	0.07
1463.9786380	0.06
1479.0333250	0.06
1517.0316160	0.27
1523.9659420	0.13
1524.9686280	0.15
1539.0135500	0.44
1588.9721680	0.13
1591.9688720	0.12
1629.4014890	0.14
1636.9670410	0.17
1731.8253170	0.10
1743.7591550	0.05
1745.2025150	0.40
1797.0220950	0.08
1826.9793700	0.16
1840.4251710	0.07
1867.8780520	0.84
1870.0579830	0.05
1874.7733150	0.19
1894.7125240	0.34
1908.7757570	0.20
1921.3991700	0.13
1923.1853030	0.19
1935.2606200	0.10
1951.7738040	0.08
1953.2369380	2.66
1956.1199950	0.11
1958.9836430	3.25
1961.5206300	0.19
1962.6300050	0.82
1963.5690920	0.26
1970.1837160	0.24
1972.3560790	0.45
1976.3664550	0.19
1983.3492430	12.11
1985.6444090	0.10
1992.2243650	0.04
1998.4036870	0.30
1999.2769780	1.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	551.1769
Annotation	Lactucaside
Peak:m/z	Relative Intensity
162.9406738	0.05
165.0458221	0.35
175.9365692	0.04
178.0359344	1.23
184.8769836	0.05
191.0566406	0.29
193.1186676	12.54
195.0994720	2.91
205.1775665	0.12
210.3595581	0.09
217.3893280	0.05
235.2958374	0.26
247.1596985	0.05
265.4118652	0.05
281.1419373	0.78
285.0078125	0.57
290.8957520	0.06
295.1411743	0.08
297.2207947	0.08
310.4679871	0.20
325.3957520	0.15
327.1208496	0.69
335.0974121	0.08
337.2518921	0.06
341.2626343	15.22
343.1618042	0.13
345.2319336	0.07
346.0274048	0.06
347.3924561	0.05
350.2731323	0.06
355.0604858	0.09
356.2781372	0.03
362.9977417	0.14
370.5728760	0.33
371.3576660	0.69
379.3332520	0.06
381.3623657	0.14
383.3601074	0.31
385.3896484	0.06
387.1890259	0.13
389.0985718	100.00
389.9258423	0.21
399.3090820	0.11
406.1214600	0.09
420.4705200	0.05
424.4572144	0.11
425.4686890	0.11
427.3046265	0.03
431.2075195	0.64
436.3572388	0.10
437.1508179	0.04
442.5168457	0.49
443.2789917	0.09
460.7749023	0.26
463.0543823	0.05
464.2006836	0.10
471.2631226	0.16
486.3160400	0.54
487.7575073	0.03
489.3938599	0.04
491.3049927	2.39
504.4700928	0.12
505.1365356	0.51
506.7151489	0.44
507.4342041	0.26
513.3071899	0.13
514.3622437	0.08
523.2351685	0.07
531.3424683	0.03
532.6407471	0.29
533.5130615	0.33
534.3674927	0.14
535.2385864	0.07
541.7371216	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	565.0472
Annotation	UDP-glucose
Peak:m/z	Relative Intensity
191.1369629	0.23
193.1822662	0.17
211.0688324	3.78
217.0251465	0.09
241.0532532	1.95
272.9299622	0.39
280.2108154	0.14
285.46698	0.14
289.1520996	0.19
294.7398682	0.17
310.7227173	0.10
321.0961914	1.22
323.0361328	100.00
327.0609741	0.10
329.1881104	0.19
333.043335	0.22
341.0872803	0.14
343.0504761	0.23
355.0806274	0.26
356.5014648	0.39
361.2617798	0.10
363.3417969	0.23
372.7050781	0.27
385.043457	2.88
386.9227905	0.08
388.1901245	0.15
389.1358032	0.89
403.1081543	4.09
418.1647949	0.29
421.5245972	0.10
422.1581421	0.22
430.9908447	1.77
432.8700562	0.41
448.0933228	0.14
459.2195435	0.13
465.3446655	0.72
467.052124	0.39
544.6704712	0.41
546.9124146	0.53
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
93.21239471	0.36
95.13085175	1.05
96.94983673	0.58
109.0131378	2.61
112.5555725	0.75
125.0378113	0.70
127.1813965	0.36
131.0072937	0.32
135.8898315	0.97
136.8008728	0.33
138.1474915	2.90
142.9558563	0.70
146.9724731	0.47
155.0032806	1.12
163.0822601	0.89
165.2883606	0.20
167.024826	1.93
171.1110687	0.55
174.0005035	0.27
175.2231598	0.87
177.0997467	1.01
179.1805878	0.50
181.1600342	1.24
183.0911255	2.59
185.084549	0.30
188.2129822	0.90
189.0801544	0.58
190.9812164	0.70
195.1203766	0.89
196.9340363	0.36
202.3645935	0.36
204.9178162	0.70
207.9938049	0.39
209.447052	0.94
210.9898071	1.82
212.7086182	2.53
215.1905518	1.95
217.2662354	0.60
219.293335	0.51
225.1314087	0.33
226.0252991	0.47
226.9983215	2.62
231.2611694	1.57
232.9151306	0.69
235.0939026	1.51
236.1216736	0.99
237.2607422	1.52
239.2777405	1.20
240.3121338	1.13
243.1856384	0.41
247.1450806	2.19
249.1575012	1.79
251.0366821	1.94
251.9985962	1.69
253.1146545	2.02
254.1576843	2.37
255.5444336	1.84
257.2600708	1.73
263.143219	2.96
263.8082275	0.38
265.1486816	7.73
266.4232483	0.33
267.388855	1.20
268.2422791	1.00
269.2163086	1.36
269.9350586	0.60
275.2723389	13.42
276.9378662	0.33
283.3911743	1.83
284.178772	0.64
288.0986328	0.53
289.9112244	1.52
291.1235352	0.80
293.2077637	100.00
297.276123	0.47
310.125061	0.86
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	699.7405
Annotation	Unknow
Peak:m/z	Relative Intensity
201.0726318	0.28
229.1425781	1.16
293.3035278	0.20
295.8670959	0.07
308.0971680	0.28
320.4572449	0.13
326.1687927	0.08
327.0214233	0.08
328.1708984	0.07
339.1541138	0.04
359.5410156	0.12
387.4153442	0.48
390.4279175	0.15
391.2795410	0.06
415.1896362	0.04
473.2800903	0.07
536.4398804	0.13
544.4164429	0.07
554.2732544	0.14
558.0610352	0.15
599.4537964	0.12
601.7879028	0.12
614.6809082	0.19
617.3860474	0.09
635.3662109	0.30
636.1038818	0.16
647.6381836	0.26
648.3703003	0.09
650.9398804	0.84
654.4601440	100.00
655.4820557	2.34
656.2371826	1.95
657.1589355	0.09
658.4735718	0.26
659.1610718	0.19
660.7911987	0.13
662.9653931	0.07
673.4060059	0.57
678.9755859	0.44
680.5831909	0.07
681.2548218	0.18
683.1301270	0.17
690.3121948	0.23
705.6483765	0.54
714.0532837	0.14
726.4262085	1.15
732.0446777	0.20
732.8479614	0.14
734.4822998	0.04
736.7142944	0.46
737.6284790	0.17
742.9151611	0.21
752.4690552	0.14
768.7805786	3.80
769.7717896	0.08
770.9939575	0.12
773.7270508	0.22
774.4628296	0.27
784.4578247	0.65
785.3087158	0.78
786.8392944	0.42
787.6308594	0.12
790.4915161	0.07
793.5444946	6.18
794.6076050	0.88
796.2081909	0.12
799.6837158	0.40
809.2885132	0.68
813.4813843	0.82
817.8594360	91.43
818.9016724	2.65
819.7439575	0.44
820.4024048	0.45
821.1572876	0.05
822.3453979	0.22
823.4485474	0.11
824.1900024	0.04
832.2608032	0.85
845.3928223	0.09
856.2020874	0.24
874.7262573	0.12
892.8383789	0.19
896.1743164	0.18
908.6087036	0.26
915.4285278	0.11
922.6292114	0.14
970.7098999	0.06
974.4436646	0.28
993.5715332	0.20
1004.8078000	0.13
1011.7443850	0.09
1019.3273930	0.50
1021.7478030	0.27
1024.6811520	0.43
1041.0371090	0.16
1103.8779300	0.20
1125.4189450	0.11
1212.7711180	0.15
1213.9034420	0.03
1217.9935300	0.17
1227.8453370	0.15
1255.8996580	0.08
1272.6192630	0.09
1290.6500240	0.13
1316.6358640	0.04
1352.2525630	0.06
1401.3073730	0.07
1405.5438230	0.12
1492.1561280	0.08
1526.3968510	0.05
1615.9185790	0.05
1623.8760990	0.20
1696.0836180	0.08
1820.6341550	0.14
1828.5806880	0.15
1832.0233150	0.18
1883.6164550	0.38
1886.3067630	0.03
1903.0081790	0.04
1905.7686770	0.06
1908.4598390	0.28
1911.0935060	0.32
1924.7647710	0.14
1933.6480710	0.29
1937.1008300	0.08
1949.7977290	0.29
1950.7103270	0.30
1952.6336670	0.17
1973.0798340	0.22
1974.0231930	0.20
1981.8157960	0.22
1983.6282960	0.09
1993.4278560	0.09
1994.8031010	0.46
1999.0457760	0.22
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
140.0096741	0.06
153.1054993	0.14
191.3603210	0.01
196.0116119	1.46
208.9955902	0.01
214.0944061	1.02
245.4479523	0.01
250.9722290	0.04
256.3015137	0.01
259.3320618	0.04
261.2246399	0.14
269.0721741	0.01
279.2597046	100.00
280.7022705	0.01
285.1958618	0.02
289.2815552	0.04
291.4076233	0.04
311.4804993	0.01
328.2589417	0.01
342.3282471	0.01
344.1768799	0.02
348.2904968	0.01
390.3387146	0.02
402.9860535	0.04
413.5650940	0.03
415.2491760	0.31
419.4133911	0.01
430.7290039	0.03
431.8075256	0.06
436.1328430	0.01
438.1055603	0.01
439.0902405	0.01
440.1120300	0.01
447.5278625	0.01
457.2752075	0.08
458.1486511	0.06
459.5132751	0.03
461.5194702	0.02
462.2843933	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	525.1205
Annotation	Ascorbalamic acid
Peak:m/z	Relative Intensity
147.3294983	0.04
156.1216888	0.14
158.0323029	3.89
159.0362244	0.22
171.9100189	0.19
174.0768433	0.09
175.1405029	0.25
181.6924438	0.12
182.3108215	0.19
182.9492188	0.22
183.6832123	0.04
188.0620117	0.12
188.9545288	0.05
200.1068726	0.92
202.0687561	8.45
212.0007782	0.17
218.0697784	1.75
219.1142273	0.33
221.1275482	0.03
221.9965820	0.04
236.2077026	0.12
244.0265961	0.58
260.5406494	0.21
262.1216736	100.00
267.9813232	0.19
298.8917847	0.05
306.4252319	0.03
311.0053101	0.85
336.0746460	0.15
346.3560181	0.49
347.2023926	0.08
348.1111450	0.59
349.2463989	0.39
353.2742310	0.06
373.9168701	0.08
388.6284180	0.36
389.3584595	0.32
392.2937622	0.11
395.2373657	0.17
407.8708496	0.06
418.6513672	0.04
422.2762451	0.27
424.9376831	0.04
427.0585327	0.43
452.2439575	0.07
453.1185303	0.07
463.9215088	0.46
465.0062866	0.85
465.7307129	0.10
477.2326050	0.08
478.0542603	0.09
479.0961304	0.23
480.2482910	0.11
482.0699463	0.88
487.2169189	0.34
488.3255005	0.11
497.2348022	0.08
507.0686035	0.36
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	645.1879
Annotation	beta-D-4-Deoxy-Delta4-GlcA-(1->4)-beta-D-Glc-(1->4)-alpha-L-Rha-(1->3)-D-Glc
Peak:m/z	Relative Intensity
189.0545197	0.39
207.0711975	0.16
208.7455444	0.06
215.0256042	0.46
227.2100983	0.07
245.0862122	0.58
246.9425964	0.14
249.1242218	0.42
263.2219849	0.28
288.7434082	0.15
290.8696899	0.25
299.1321411	0.23
303.2224121	0.63
305.1309204	1.39
310.6587219	0.20
316.6454468	0.15
317.2825928	0.13
321.1646423	2.46
322.2022705	0.04
329.3175354	0.14
335.3820801	0.04
341.4801025	0.06
343.0283203	0.34
349.1691895	0.05
358.8685913	0.32
361.2738037	0.45
371.2085571	0.14
372.0916748	0.18
375.2269287	0.11
376.6037598	0.12
377.2749023	0.76
381.1678467	3.57
387.4962769	0.13
388.8377075	0.06
391.3514404	0.07
393.4185181	1.13
403.1694336	0.93
411.3101807	0.46
416.9472656	0.21
419.5120850	0.18
421.1702271	1.41
435.2734375	3.58
451.2310791	0.14
453.1634521	14.85
457.9981689	0.15
463.0463867	0.89
464.2392578	0.09
471.1927490	2.62
475.2255249	0.15
477.1646118	0.10
481.1580811	1.36
483.3004761	0.18
489.3513794	0.10
493.3096313	0.40
495.2139282	1.24
506.9087524	0.20
509.4436646	0.12
513.2007446	42.17
516.7850952	0.16
520.1002808	0.08
525.1031494	1.21
535.2833862	2.44
538.2833252	0.10
539.8773193	0.20
541.9974976	0.18
543.3599854	0.68
549.0397339	0.11
553.3142700	1.66
555.3047485	0.88
567.3119507	30.49
568.1465454	0.09
571.4461060	0.64
585.2272339	100.00
585.8390503	0.27
598.4932861	0.09
600.4623413	0.12
601.3906860	0.06
603.2990112	9.55
609.3795776	0.28
610.7117310	0.13
613.3112183	3.31
626.4725952	0.16
627.3993530	0.13
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
106.7485199	0.30
108.6822891	0.06
110.8896484	0.48
113.1563568	0.11
129.0246277	0.08
132.1718445	0.05
134.9686890	6.19
136.4223328	0.16
137.0427399	1.01
142.9087677	0.06
145.1499939	0.05
153.0051270	0.11
154.9951172	1.43
156.9212952	0.14
161.0167236	0.69
164.0333557	0.06
168.0110474	0.09
172.9878082	100.00
179.0869904	62.57
190.9937744	57.72
214.8302612	0.13
217.1566467	0.19
225.0830994	0.06
231.3256836	0.11
232.1075439	0.44
244.5266724	0.05
246.2095947	0.26
248.2488098	0.08
249.2388916	0.05
261.2701416	0.22
262.1115112	0.33
263.1462402	0.25
264.2859497	0.14
271.3273315	0.10
277.1597595	0.35
278.3930664	0.05
291.4937744	0.15
292.2019348	0.79
293.1800232	0.16
295.4557190	0.07
299.2277222	0.04
305.8055420	0.13
306.9956665	0.38
308.1117554	0.14
309.3135376	0.08
316.1635132	2.74
317.3386536	1.13
321.1527100	0.07
324.2938843	0.11
334.1020813	0.37
334.9358215	1.16
335.5498047	0.08
338.0843201	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	977.13
Annotation	Unknow
Peak:m/z	Relative Intensity
293.2366028	0.11
300.3622131	0.09
333.0112305	0.14
379.3835449	0.04
425.1982422	0.09
459.1020508	0.08
494.3773804	0.09
512.4464111	0.15
564.1048584	0.04
615.0838013	0.09
648.3916016	0.11
656.4334106	0.16
677.9893188	0.06
717.1193237	0.07
762.5075073	0.39
773.6478882	0.39
795.9938965	0.05
807.0512085	0.16
813.9590454	0.38
831.5259399	0.18
853.0170898	0.23
856.0363770	0.19
867.2756958	0.05
877.7113037	0.06
912.0811157	0.11
922.2460327	0.30
924.3481445	0.30
926.3778687	0.32
928.6484375	1.20
932.1242065	0.80
933.5473022	0.96
935.0176392	1.72
936.0810547	0.41
938.9174194	1.64
939.9075317	2.09
942.0750122	4.53
942.7428589	0.97
943.8322754	1.45
944.8082886	11.29
945.7985229	1.68
946.8596802	0.27
947.4818726	0.73
948.4437866	1.71
949.6841431	1.55
951.4223022	6.32
952.2039185	1.16
953.6508789	11.49
954.4874878	0.69
956.2283325	6.49
957.5466919	1.48
958.7509766	1.89
959.5942383	0.09
960.3864746	1.46
961.2268677	0.20
962.2944946	1.92
963.0410767	0.12
963.7075806	0.21
964.5272827	2.17
965.1467285	0.66
966.2522583	0.50
967.4685669	0.56
969.6135864	0.22
970.9900513	0.26
975.5253906	0.13
998.9605103	0.77
1017.6156620	0.12
1019.3037720	0.77
1019.9926760	0.47
1021.5353390	0.39
1029.4672850	0.69
1031.1531980	0.04
1035.4536130	0.55
1038.7121580	0.56
1039.6193850	0.43
1042.0140380	0.91
1046.3861080	0.11
1048.1140140	1.13
1049.7933350	0.56
1051.6011960	2.30
1052.6425780	1.59
1055.4947510	0.79
1056.6062010	0.85
1057.4820560	1.12
1058.6138920	0.04
1059.4215090	0.28
1060.6252440	2.83
1061.4340820	1.49
1063.0905760	4.77
1063.8992920	1.00
1066.0058590	12.00
1066.8795170	2.45
1068.7298580	3.99
1069.6699220	1.81
1071.0239260	0.14
1071.9848630	1.19
1073.2128910	0.46
1074.6239010	0.07
1075.4396970	1.35
1077.5307620	3.86
1078.3386230	5.19
1079.5295410	2.31
1080.3666990	3.34
1081.5810550	3.49
1082.6011960	0.80
1083.6384280	2.44
1084.6855470	7.67
1085.4891360	1.03
1087.1068120	3.51
1087.9846190	2.93
1089.4807130	2.88
1090.5050050	1.70
1091.3563230	1.32
1092.1643070	1.38
1093.2005620	4.51
1094.0605470	4.54
1094.9739990	2.95
1096.0649410	4.16
1097.2033690	1.98
1098.3791500	7.82
1099.3012700	9.81
1099.9796140	1.73
1100.8503420	1.41
1101.4801030	6.34
1102.1650390	6.98
1102.9134520	2.66
1104.2363280	12.68
1105.4888920	3.68
1106.7315670	2.79
1107.3967290	0.73
1108.2453610	1.25
1109.3602290	5.84
1110.2492680	2.03
1110.8728030	2.47
1112.2310790	15.25
1112.9394530	8.70
1114.1157230	0.67
1115.3688960	100.00
1116.7458500	4.65
1118.2435300	15.98
1119.1789550	1.70
1120.3339840	2.35
1121.2354740	3.83
1122.0838620	0.83
1123.1386720	2.05
1125.0611570	3.77
1126.8369140	5.35
1129.1638180	0.98
1130.3820800	0.66
1131.3063960	1.66
1133.8044430	7.25
1134.5012210	0.99
1136.2962650	1.10
1136.9683840	17.09
1138.1645510	0.13
1140.7144780	0.37
1145.3240970	0.50
1148.3574220	0.80
1150.9562990	0.60
1152.1356200	0.45
1154.0148930	0.43
1155.4816890	0.67
1158.4875490	1.88
1160.1546630	1.32
1161.8559570	0.50
1166.4340820	0.46
1172.1247560	1.16
1174.1303710	0.35
1176.3095700	0.30
1181.3959960	0.76
1187.8988040	0.08
1188.9349370	0.92
1189.7747800	0.54
1194.1829830	0.94
1195.5664060	1.64
1204.1723630	0.97
1204.8507080	0.87
1207.3558350	0.09
1209.3701170	0.08
1210.0596920	0.34
1211.9370120	1.79
1213.1623540	1.19
1214.6822510	0.57
1217.3177490	1.04
1218.0080570	1.02
1219.0380860	0.57
1222.7296140	1.00
1224.7193600	1.40
1225.8109130	0.89
1228.2479250	0.50
1229.1063230	1.44
1230.4804690	0.92
1231.1496580	0.48
1232.5173340	2.45
1233.6053470	1.19
1234.8575440	0.66
1235.9885250	0.05
1237.8184810	1.72
1239.3276370	0.67
1240.0010990	2.04
1240.6445310	0.69
1241.2816160	0.04
1242.6645510	2.11
1243.7138670	2.07
1245.0561520	0.59
1245.7500000	0.52
1247.4675290	0.08
1248.3226320	0.31
1249.0364990	0.47
1249.8557130	2.28
1250.5244140	0.48
1251.9135740	2.25
1253.2545170	1.78
1254.7856450	0.55
1256.2009280	1.57
1258.0961910	0.58
1260.3546140	1.31
1261.3481450	0.89
1262.1870120	0.44
1263.4582520	0.85
1264.8813480	1.39
1265.9379880	1.20
1267.3215330	1.12
1268.9755860	4.15
1269.6433110	1.20
1271.6608890	1.05
1272.6245120	0.76
1273.8354490	0.68
1275.4213870	1.32
1276.1236570	1.49
1277.1660160	0.66
1279.1195070	1.39
1280.7119140	1.86
1281.7969970	0.72
1283.3077390	0.96
1285.7208250	2.27
1286.9276120	2.09
1289.1055910	2.76
1290.1762700	2.48
1292.5804440	2.08
1293.2569580	1.89
1294.7741700	0.66
1295.3828120	1.51
1296.8205570	0.98
1297.7016600	1.24
1298.4543460	0.23
1299.3763430	0.60
1300.2987060	0.30
1300.9998780	2.36
1301.9055180	0.71
1302.7611080	1.42
1303.6403810	0.72
1304.7938230	0.61
1305.6602780	1.53
1306.7978520	0.15
1308.6361080	0.81
1309.3758540	1.25
1310.5860600	0.77
1312.3887940	1.51
1315.8443600	1.09
1317.1099850	0.07
1317.8573000	0.17
1319.1602780	2.55
1320.6390380	1.78
1321.8843990	1.80
1323.2165530	0.11
1326.6405030	0.51
1327.6057130	0.65
1328.5837400	1.06
1330.4649660	0.52
1331.0938720	1.10
1337.4949950	0.48
1338.3812260	0.88
1340.0578610	1.40
1341.1434330	0.34
1347.0797120	0.53
1347.7877200	0.56
1349.8544920	0.39
1354.4890140	0.60
1357.0976560	1.03
1361.8975830	0.43
1366.0078120	1.43
1374.6927490	0.35
1378.3936770	0.46
1383.2479250	0.31
1391.1829830	0.25
1394.8876950	0.25
1400.7861330	0.32
1403.4769290	0.33
1405.8278810	0.12
1408.3452150	0.71
1411.1752930	0.45
1413.4495850	0.38
1414.7103270	0.79
1420.2272950	0.37
1425.1784670	0.39
1427.3701170	0.19
1428.4089360	0.19
1431.3079830	0.42
1436.3808590	0.11
1442.8817140	0.48
1443.7434080	0.30
1447.2534180	0.60
1468.3964840	0.13
1480.4345700	0.30
1488.9381100	0.04
1493.1264650	0.28
1503.5064700	0.82
1511.5755620	0.28
1513.8092040	0.95
1515.6234130	1.09
1516.6209720	1.33
1517.2991940	0.24
1518.2324220	1.07
1519.7796630	0.34
1522.1197510	0.41
1553.6545410	0.45
1556.5106200	0.11
1560.4963380	0.25
1568.2410890	0.72
1583.5413820	0.26
1587.4255370	0.35
1590.4539790	0.34
1592.1744380	0.41
1593.4830320	0.28
1597.7348630	0.28
1600.8756100	0.46
1615.1573490	0.11
1615.8497310	0.37
1643.8524170	0.04
1646.9534910	0.22
1673.0061040	0.05
1700.3787840	0.13
1736.0340580	0.21
1775.0802000	0.06
1812.9698490	0.05
1850.6585690	0.04
1863.4683840	0.14
1867.5006100	1.26
1872.2335210	0.09
1873.1568600	0.06
1876.2136230	0.08
1898.2803960	0.25
1901.1116940	0.12
1920.5826420	0.13
1932.8043210	0.07
1935.7312010	0.05
1938.1066890	8.09
1948.6301270	0.54
1956.9735110	0.83
1958.0999760	1.39
1973.4014890	0.17
1974.3303220	0.13
1975.2967530	0.52
1976.1483150	0.10
1979.0422360	0.11
1982.5697020	0.33
1985.9080810	0.04
1988.3889160	0.51
1995.2458500	3.63
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	728.8802
Annotation	Unknow
Peak:m/z	Relative Intensity
229.1277008	0.13
273.0172119	12.26
274.0231323	3.39
274.9495544	2.12
387.0192871	13.22
387.9747314	8.33
389.0114136	6.80
498.9295044	0.10
500.9409180	47.76
501.9611206	51.30
502.9041138	50.01
503.7719116	0.24
543.1212769	0.30
568.9860840	0.64
583.5352783	0.12
597.2444458	0.38
598.0899658	0.16
601.1126709	0.13
614.9458618	45.58
615.8831787	75.94
616.8450317	100.00
617.7388306	0.33
628.0514526	0.19
629.0300903	0.24
629.7020264	0.18
638.6376343	0.09
656.0252075	3.55
656.9239502	2.25
658.1655884	0.37
673.9539185	1.05
674.8547363	1.54
676.2467041	0.17
683.9251099	0.71
684.8457642	0.78
698.7951050	0.32
701.9030151	0.10
731.8605347	0.72
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	461.995
Annotation	Unknow
Peak:m/z	Relative Intensity
136.0128479	0.13
172.9792633	0.25
182.9689636	0.33
212.9086304	0.17
219.8614960	0.68
282.0021667	0.29
289.7878418	0.23
299.8708191	3.76
322.3477783	0.67
330.2049561	0.51
346.3755493	0.84
357.3534546	0.53
368.9447632	1.14
382.1519165	100.00
395.2920532	0.34
400.4958191	0.34
440.6430359	0.32
443.7711182	0.84
444.7842102	0.83
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	654.0008
Annotation	Unknow
Peak:m/z	Relative Intensity
188.9647064	0.03
234.2198944	0.17
263.1692505	7.97
264.2190552	1.00
265.0977478	0.07
281.2112122	0.54
298.5570068	0.09
328.3087769	0.04
330.3346558	0.07
343.0027466	0.17
364.2795410	0.81
365.2990112	0.30
371.9018555	0.04
388.1696777	0.05
394.0218506	0.06
397.5851440	0.05
407.4484863	0.08
415.3701782	0.27
416.3647461	0.21
420.7570190	0.10
430.2589111	0.08
433.1881714	0.03
434.2525635	0.04
439.1904907	0.15
442.2199707	0.09
450.0096436	0.18
451.2316284	0.35
452.2419434	0.27
455.4799194	0.10
457.1872559	2.14
465.3673706	0.12
473.2744141	0.04
474.0239258	0.09
474.9931030	1.12
499.6815796	0.02
500.5122070	0.05
528.1126099	0.11
529.4713745	0.02
535.6835938	0.34
554.9514160	0.13
560.9755249	1.75
561.6636963	0.12
562.4099731	0.05
563.5304565	0.08
564.2603149	0.20
565.1904907	0.04
566.4513550	0.23
567.5366821	0.26
572.1500854	0.15
573.3756714	0.07
577.3997192	0.10
581.1491699	0.39
582.9236450	0.22
584.7196655	0.36
587.4612427	0.13
588.3581543	0.14
591.7440186	0.87
593.1527710	0.60
593.7748413	1.13
595.2921753	0.06
598.8778076	0.80
599.6571655	0.07
601.5420532	0.12
605.4372559	0.17
607.8997803	0.13
610.4395142	0.33
611.4144897	0.07
618.1981201	0.16
624.9605103	0.04
626.1910400	0.24
631.3164673	0.15
633.2876587	0.23
634.8728638	0.14
636.0112915	0.19
637.0715942	0.14
637.9262695	0.77
639.2442627	1.21
639.9353027	0.88
640.7484741	0.14
642.3886108	43.88
643.2268677	1.49
643.9788818	0.14
644.8383789	0.44
646.4006958	0.15
691.7472534	0.19
692.5473633	0.04
698.2112427	0.04
699.3269653	1.95
700.2106323	0.07
703.3975830	0.14
726.7188721	0.08
734.5317993	0.06
736.8619995	0.27
742.5836792	0.09
747.0858765	0.20
747.7798462	0.12
755.6889038	8.19
756.5581665	2.76
758.8359985	0.03
761.1333618	0.03
764.9810181	0.08
765.7105713	0.04
775.7561035	0.20
780.3502808	0.10
790.2064819	0.65
791.2778931	0.13
793.0512695	0.12
799.2094116	6.76
800.0868530	0.74
808.2866211	0.24
812.6437378	0.06
827.5720825	0.57
828.2742310	0.70
831.7072144	1.01
832.6679077	0.24
835.8848267	0.46
840.4791260	12.08
841.1920166	15.46
842.0388794	0.89
842.8644409	0.15
849.7704468	100.00
850.5914917	14.97
851.7155762	0.03
852.4006348	0.04
853.2702637	0.23
854.5515137	0.12
857.2844238	0.07
859.0654297	0.08
898.1079712	0.05
900.8637695	0.21
907.2848511	0.36
915.8018188	0.36
977.0801392	0.02
988.1881714	0.06
991.6051636	0.04
999.3141479	0.08
1017.6513670	0.13
1027.6264650	0.11
1076.0419920	0.16
1100.5379640	0.09
1151.7408450	0.09
1152.7500000	0.06
1153.5469970	0.16
1155.1425780	0.07
1160.1843260	0.17
1181.8759770	0.04
1243.8039550	0.11
1731.8801270	0.07
1834.6085210	0.02
1851.5189210	0.06
1871.1368410	0.04
1876.2009280	0.04
1877.2043460	0.04
1880.2062990	0.69
1882.2918700	0.09
1896.0577390	0.38
1896.8669430	0.09
1902.3741460	0.14
1908.6979980	0.06
1912.9049070	0.20
1917.7198490	0.05
1920.1397710	0.05
1939.5694580	0.68
1947.6619870	1.36
1956.9401860	1.64
1959.1878660	0.05
1964.8713380	0.03
1970.8070070	0.03
1971.7037350	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	316.1414
Annotation	Unknow
Peak:m/z	Relative Intensity
96.8341370	0.19
113.0984039	0.03
113.9923935	3.64
116.0143051	0.06
131.0659485	1.50
138.1323395	0.22
151.9147949	0.12
152.9551086	0.14
155.0274658	3.36
156.0901489	8.93
157.0308533	3.13
173.0346069	13.65
181.1654663	0.09
182.2075806	0.42
183.9757996	0.41
193.2236633	0.02
199.0405273	100.00
206.7641907	0.02
210.0608521	0.16
227.8771667	0.04
229.2934875	0.05
235.1837158	0.21
253.1752930	0.04
254.2485657	0.03
256.2656860	1.08
258.1739502	0.14
259.1599121	0.11
260.8994141	0.03
268.2148438	0.15
270.0605469	0.23
271.1883545	0.06
272.1645813	0.08
273.1424866	0.04
274.2550964	3.15
280.1161194	0.03
281.2177124	0.14
285.1778259	0.04
286.2524414	0.24
287.9762573	0.05
295.2943420	0.14
297.8410950	0.55
299.0800781	0.62
299.6899719	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	319.1507
Annotation	Unknow
Peak:m/z	Relative Intensity
139.4131470	0.17
140.0184021	0.11
181.0482483	0.08
182.3289032	0.07
191.1662598	0.03
233.1074524	0.85
234.1786804	1.57
242.1749268	0.07
259.1492615	1.49
260.3378906	0.17
273.9619141	0.19
275.2518616	0.57
277.1734924	100.00
284.1812439	77.10
301.2016907	18.75
302.1088257	23.52
302.7507324	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
108.8831787	0.10
111.0901489	0.21
113.0757599	0.05
114.8558884	0.05
126.9188843	0.07
133.9264374	0.14
135.0397644	7.64
136.8488922	0.72
144.8907623	0.05
145.8691864	0.14
155.1311646	1.83
160.9535980	0.33
162.8943176	0.08
173.0592194	100.00
174.9348602	0.22
176.0820160	0.10
178.9705505	60.77
179.8313141	0.09
181.1609192	0.05
185.3663025	0.05
190.1766663	1.56
191.1041870	22.08
196.8416290	0.17
203.1490784	0.30
208.7846832	0.08
209.7465363	0.08
216.9396973	0.10
223.1181641	0.21
232.2225952	0.21
239.1614685	0.07
242.3049622	0.10
249.1419373	0.09
251.5448303	0.06
261.5713501	0.20
263.0581665	0.37
265.2056274	0.13
267.0615845	0.09
271.1645508	0.13
277.1094971	0.07
280.8512573	0.16
284.9936523	0.10
291.0470581	0.07
291.9980164	0.09
293.2169189	0.17
294.1803284	0.15
297.0101929	0.20
299.1351929	0.05
302.2572632	0.11
307.0888367	0.07
308.3065186	0.32
309.1770020	0.32
316.1298218	0.35
316.9687195	0.10
333.9068909	0.17
335.1236572	1.11
338.2674255	0.28
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	452.2784
Annotation	PE(16:0/0:0)
Peak:m/z	Relative Intensity
195.8077698	0.55
200.9961853	0.05
214.1511230	1.60
216.0513306	0.11
226.1230774	0.19
255.2786255	100.00
267.4045410	0.07
283.3852844	1.87
284.4704285	0.05
311.3105774	0.12
334.4872437	0.11
336.5215454	0.10
339.3965149	0.28
340.3708496	0.10
377.4696960	0.15
379.4209900	0.04
388.3857117	0.08
390.4507141	0.45
391.4317322	0.07
406.2170105	0.04
409.0580750	0.07
414.2371216	0.15
415.7729187	0.13
421.4020691	0.25
424.2190247	0.06
429.4512634	0.23
433.5111389	0.48
434.3429565	1.18
435.2804871	0.18
438.9203186	0.11
451.7269897	0.16
452.4645691	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	531.1697
Annotation	Pikuroside
Peak:m/z	Relative Intensity
169.1687012	0.04
175.0277557	6.58
180.9852448	0.07
189.0420837	0.12
199.1514893	0.03
207.0892944	37.40
219.4193573	0.07
221.1905518	0.05
225.0783081	1.18
235.0595703	0.09
237.2060547	0.13
246.9473877	0.11
255.2142792	0.10
258.9448242	0.04
260.8632812	0.27
263.1903076	0.22
287.3267212	0.14
291.1611938	1.64
303.4168091	0.20
315.2753906	0.25
317.3543701	0.02
321.1801147	0.38
324.2819824	0.03
325.2663574	0.16
329.4172974	0.25
331.2482910	0.07
333.0626221	1.19
335.3071899	0.10
349.3195190	0.05
351.0532227	30.20
351.6968384	0.20
358.2124023	0.08
369.0616455	100.00
369.6826172	0.47
382.5458374	0.15
384.0477295	0.10
387.1984253	0.04
415.4676514	0.02
417.8090820	0.11
423.2625122	0.05
425.9558716	0.50
439.3793335	0.05
449.4155884	0.24
458.3406982	0.07
461.1431274	0.13
465.9645386	0.11
466.9646606	0.03
468.3679199	0.10
470.2067871	0.29
473.2391357	0.08
486.1509399	0.13
494.4351196	0.17
495.2932739	0.10
505.3390503	0.23
512.2840576	0.22
513.0819702	0.78
514.5408936	0.09
519.9297485	0.10
534.9977417	0.04
541.4395752	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	723.2136
Annotation	Apigenin 7-rhamnoside-4'-rutinoside
Peak:m/z	Relative Intensity
201.9730988	0.05
203.0579834	0.03
205.0675964	0.12
206.3418884	0.04
208.1246948	0.02
215.1152344	0.21
216.3974304	0.17
217.0764771	1.39
223.0453186	1.19
230.2705688	0.03
231.1607208	0.24
232.0222473	0.05
233.1346130	0.05
235.2057343	0.32
242.0242615	0.23
243.1579285	0.11
244.1355286	0.03
245.1074219	0.17
246.2115021	0.03
247.1402435	0.71
249.1421356	0.08
251.4330139	0.05
257.3651733	0.17
259.1226196	4.68
261.1341858	0.07
265.1842041	0.28
272.1055603	0.13
274.1493530	0.18
277.2455139	0.15
283.3060913	0.12
287.2253418	0.05
289.1188354	0.77
295.2257690	0.12
301.0784302	1.11
305.3393250	0.08
308.7465820	0.06
319.2029419	0.18
323.5356750	0.04
325.2416992	0.05
331.0735474	0.12
349.4876404	0.02
355.3499146	0.02
367.4584961	0.16
385.1390991	0.04
397.3699951	0.27
403.1024170	0.06
409.1450195	0.04
413.3815918	0.08
415.5774536	0.03
427.3515625	1.28
436.8192749	0.07
439.1573486	0.09
453.3721924	0.09
457.0690918	0.47
463.4703369	0.05
465.2685547	0.04
469.2926025	0.02
481.1985474	0.42
485.3863525	0.52
487.1688843	0.59
492.3970337	0.05
499.2109985	100.00
505.3730469	0.03
511.1525269	0.10
515.2316895	0.11
516.9718018	0.15
529.1575317	6.49
529.7612305	0.01
542.2335205	0.07
545.5643921	0.06
557.4412842	0.04
560.6426392	0.09
561.4345703	0.36
571.0646973	0.04
573.2150269	0.07
586.3107300	0.02
596.5900879	0.04
598.8635864	0.03
609.2993774	0.02
624.7284546	0.09
626.1690063	0.02
627.1485596	0.12
633.2953491	0.03
637.0303345	0.03
637.6450195	0.08
661.0087280	0.10
661.6868286	0.15
663.2387085	0.13
670.3178101	0.04
676.2090454	0.08
679.3997192	0.14
680.5254517	0.08
686.2968140	0.05
687.3727417	0.08
700.5557251	0.04
704.9671631	0.04
705.6438599	0.17
706.3004150	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	445.1608
Annotation	Ugonin P
Peak:m/z	Relative Intensity
170.4514465	0.14
171.0992432	0.41
176.8441925	0.15
183.1408997	0.32
202.9710999	0.12
211.1304321	0.14
213.3171692	1.04
217.2973022	0.30
219.1685791	0.16
220.2889099	0.08
224.0759735	0.13
227.1673126	0.63
235.6101532	0.29
242.2228699	0.27
243.9479370	0.45
246.5320740	0.08
253.0893860	2.68
254.2576599	0.30
255.1379700	0.53
263.4321594	0.12
267.2599182	0.51
269.2684937	0.11
274.4847717	0.24
281.4302063	0.61
283.2467651	4.92
284.3490906	0.67
295.2631226	0.11
297.1618042	0.90
298.2389221	0.98
301.2316589	43.43
307.4306335	0.66
309.2662354	0.33
315.2243347	27.18
316.2094116	0.90
317.2907410	0.25
324.0761719	1.34
325.2595825	3.71
338.2296448	0.23
342.0794678	0.11
343.2600403	64.45
344.2923584	1.72
355.2617798	0.14
355.9671631	0.13
357.2681885	0.16
365.2495728	3.20
366.2299805	0.11
367.1198425	0.47
369.7243958	0.81
370.8435669	1.92
371.7467957	0.84
381.1064148	0.21
383.2478943	100.00
385.1587219	21.71
386.2944946	0.33
387.3349304	0.30
391.2792358	0.68
396.1293030	0.24
397.2568054	1.94
398.8596191	1.09
399.4693604	0.21
400.4371033	0.12
401.8022766	0.78
404.0569458	0.10
409.3568420	0.80
413.1657410	0.16
415.6393738	0.22
416.4828796	0.49
427.2513428	60.20
428.3791809	0.94
429.1221008	0.20
436.0818481	0.10
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
176.9243164	0.16
194.9051819	0.03
212.8455505	8.54
252.9841003	0.05
282.1428833	0.19
294.7283325	0.10
296.7988892	100.00
315.3621826	0.06
320.9251709	0.06
332.8546143	0.14
334.7488708	42.04
335.3693237	0.31
336.8128052	0.07
352.1933289	0.05
362.2390747	0.92
380.4829102	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	403.1971
Annotation	Staphylionoside C
Peak:m/z	Relative Intensity
125.0642853	0.03
128.8466187	0.21
148.1521912	0.05
163.0146179	0.10
183.2963257	0.09
185.4214172	0.07
199.1320038	1.77
213.1432190	0.23
215.2166138	0.11
219.2963562	0.08
230.9632263	0.04
235.1467285	0.18
241.4884949	0.08
243.1753845	0.07
244.1172791	0.06
255.0351257	0.07
259.1583557	0.08
261.3095093	0.06
262.1856384	0.03
265.1814575	0.05
269.0007324	0.05
269.9960022	0.03
272.8567810	0.14
275.5377197	0.10
277.3524780	0.11
279.2590942	0.13
289.0030518	0.09
293.2064209	0.25
295.2219238	0.12
299.1518250	0.11
303.1498718	0.07
305.0523682	0.07
307.1257935	0.38
311.3383179	0.11
313.4531860	0.06
315.4447021	0.07
317.2934570	0.18
325.2810059	0.25
327.3511963	0.16
329.1705933	0.18
331.5919800	0.09
340.4620972	0.06
341.2942505	0.02
343.2351685	67.00
344.1098938	0.02
345.3581543	0.46
349.1428223	0.37
351.7335815	0.26
357.2170410	0.30
357.9175720	0.12
359.1242981	0.57
361.2494812	100.00
361.8632202	0.27
364.9126282	0.10
365.8224182	0.30
367.2172546	1.00
368.2715149	0.07
373.2417297	0.04
375.3251953	0.05
381.2197266	0.06
383.0975952	0.08
384.4855957	0.51
385.3150024	1.70
385.9947815	0.11
388.6831055	0.05
389.4259644	0.29
391.1014709	0.11
392.5816040	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	556.1039
Annotation	Unknow
Peak:m/z	Relative Intensity
159.0636139	0.10
161.9986420	0.25
163.2524109	0.09
178.9112244	0.04
229.3302002	0.05
270.8806152	0.02
272.1740723	0.04
282.1729126	0.08
283.3948364	0.04
296.0917969	0.03
298.2999268	0.13
308.6823730	0.05
310.0189209	0.07
311.0315552	0.07
333.5280151	0.12
341.3529663	0.05
368.3886719	0.07
369.1744995	0.02
374.2554932	0.06
387.5019531	0.06
389.2864990	0.06
392.9300537	0.15
401.0906982	0.03
408.1873169	0.02
410.0347900	100.00
411.1065063	23.60
419.8441162	0.04
427.1470947	0.11
428.2957153	0.17
433.4724731	0.04
440.4391479	0.21
442.3225098	0.12
445.4006348	0.09
451.8242188	0.06
454.2598877	0.04
474.8923340	0.14
481.3362427	0.06
482.1464233	0.09
497.5285034	0.04
520.8150635	0.16
534.1907349	0.13
536.9957886	0.03
538.2849731	0.39
539.3605347	0.35
547.5169067	0.12
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
200.0494385	0.34
273.0646057	0.95
274.1614380	0.63
274.8963013	0.30
386.8335571	0.78
388.2963867	0.70
426.9774170	1.54
428.9743652	2.40
473.0324097	1.76
473.9901123	0.80
475.0075073	7.75
502.9395142	1.19
529.9159546	0.28
541.2636719	6.06
541.8956909	46.71
542.8715820	100.00
543.5117798	0.52
560.7776489	1.40
561.8425903	0.80
570.1736450	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	304.96
Annotation	Unknow
Peak:m/z	Relative Intensity
139.1521912	0.10
169.5711517	0.39
198.9643555	0.19
207.1997375	0.13
224.8627930	0.47
258.1096802	0.35
259.0902710	0.40
260.9258728	0.07
263.8262939	100.00
264.4277954	0.60
268.9978027	0.07
277.4154358	0.09
280.3411865	0.16
281.5942993	2.78
282.4558105	0.38
283.7597046	0.64
287.1466675	0.35
293.5833130	0.57
296.6785278	0.51
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	524.1278
Annotation	Unknow
Peak:m/z	Relative Intensity
160.2285614	0.15
169.3920288	0.05
171.3247070	0.03
176.9780426	0.50
179.0733795	1.13
183.3979340	0.03
185.0342407	0.16
192.0613861	0.17
195.0278931	0.22
196.1839600	0.06
197.2287903	0.05
200.9598694	0.04
210.1531219	0.92
212.9208984	0.13
214.9689636	0.08
220.2770233	0.09
223.1368256	0.30
225.2003479	0.22
235.9402466	0.14
242.2967529	0.03
243.0809631	0.04
254.1805420	3.22
259.1318359	0.06
272.0928955	4.78
276.1992798	0.11
279.9853821	0.10
288.1353760	2.61
291.1408691	0.10
298.2236938	0.06
303.9738159	0.09
306.0819092	100.00
313.2393799	0.28
313.9514771	0.03
317.7034302	0.04
327.2999268	0.65
331.9625244	0.13
339.0787354	0.21
343.2938232	0.16
344.3024292	0.09
345.1545410	0.05
361.1438599	0.33
365.1814575	0.04
375.9212036	0.09
387.2623901	0.32
388.0585938	0.05
395.2683716	0.03
407.3530273	0.08
419.4872437	0.03
421.2437134	0.05
425.1623535	0.13
426.3848267	0.11
428.0865479	0.08
435.2091675	0.06
438.3322754	0.04
448.7766724	0.15
450.3414917	0.03
451.1006470	0.19
458.3945312	0.16
459.2059326	0.15
460.2632446	0.08
461.2412720	0.09
464.2977295	0.04
465.6144409	0.05
475.4152222	0.20
477.1178589	0.03
478.1564331	0.28
479.1387329	0.16
479.9826050	0.07
484.6529541	0.30
487.2604370	0.12
487.9047852	0.55
488.5264282	0.03
490.3380737	0.18
491.0026245	0.12
493.4884033	0.09
497.0753784	0.07
505.0708008	0.49
506.0343628	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	302.84
Annotation	Unknow
Peak:m/z	Relative Intensity
99.1356888	0.03
128.9594116	1.23
145.1440735	0.02
155.1057434	0.01
182.2794495	0.04
201.1215210	0.05
213.1825256	0.04
218.8200378	100.00
240.3586121	0.08
241.1888123	0.01
256.3413696	0.05
256.9934692	0.07
258.3124390	0.03
284.1833191	1.13
285.2921143	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	325.0929
Annotation	6-O-p-Coumaroyl-D-glucose
Peak:m/z	Relative Intensity
96.9806595	0.10
111.3117828	0.14
112.8134995	0.51
116.9344177	2.45
119.0618744	9.71
145.0368347	100.00
146.0556030	0.14
159.0253754	1.05
160.9668274	0.86
163.0617371	88.86
171.1529236	0.12
173.0700684	0.91
175.0355377	0.13
177.0170135	0.49
178.9781342	0.11
183.8406067	0.17
187.0697937	48.69
189.0093994	0.52
190.1133575	0.11
203.0497894	0.66
205.0493164	9.20
209.3270874	0.22
214.3576660	0.14
215.0654297	0.14
217.1176758	1.61
227.8351746	0.13
229.1728821	0.64
234.9899292	9.26
235.6178589	0.17
245.1290283	0.65
247.0078125	0.19
253.3681030	0.14
259.1813049	0.11
261.3934937	0.51
263.1267090	0.21
265.0322266	20.07
265.6583862	0.26
267.0148315	0.06
279.0575562	0.19
280.3752441	0.21
281.0668640	0.18
288.0419006	0.05
288.9999390	0.31
294.7735596	0.07
307.2616577	2.16
308.0993042	0.12
310.1517334	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	501.0919
Annotation	Unknow
Peak:m/z	Relative Intensity
145.2364197	0.35
176.9941864	2.71
179.0419312	0.09
190.8938599	0.06
195.0697327	0.38
242.9254150	4.79
255.1308899	0.49
256.6497192	0.12
261.0820312	0.29
268.9031067	0.08
294.8509521	0.09
297.0288086	0.42
303.1542969	0.43
308.3932190	0.27
321.0641785	1.04
339.1278076	6.52
354.0565491	0.22
372.0825195	100.00
410.0040588	0.39
413.2882080	0.77
414.3550110	0.16
426.0880127	4.40
433.5148010	0.82
436.4643250	0.48
440.2841187	0.37
441.0879822	0.26
447.3177795	0.16
455.4200439	0.35
464.2555237	0.25
483.1101990	1.33
483.7793884	0.11
485.9348450	0.11
492.0618591	1.51
492.7063904	0.67
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	423.1786
Annotation	Ugonin P
Peak:m/z	Relative Intensity
120.1193695	0.02
130.0095520	0.28
146.0742950	0.07
149.0453033	0.09
163.6160583	0.04
164.6075745	0.04
174.3128052	0.02
176.9972839	0.41
181.9817505	1.14
192.0523224	0.76
193.7962189	0.38
199.0925446	0.02
206.7931976	0.06
211.0279999	1.04
212.5765839	0.06
213.4310150	0.11
218.1294708	0.03
233.9061890	0.03
235.1374817	0.06
243.1197510	0.07
244.9335938	0.18
250.9594116	0.04
265.1698914	0.08
277.1140747	20.08
277.9597778	1.37
280.8542175	0.14
293.1746521	3.37
295.0101318	100.00
299.2645874	0.07
302.6933594	0.12
304.3338623	0.06
305.9633179	0.08
307.9984741	0.12
316.3352661	0.08
317.2092896	0.08
321.9472351	0.07
331.0795288	0.16
333.1010132	0.03
339.0546570	0.06
340.0838013	0.18
343.7316284	0.14
344.3371582	0.10
349.1260986	14.41
349.7654724	0.05
357.7241821	0.03
360.0781860	0.02
361.1457214	0.23
363.6805115	0.03
364.4183044	0.02
376.3642883	0.05
388.0950012	0.12
389.2371521	0.04
395.5844727	0.11
402.7968445	0.05
405.2026672	0.59
406.2393799	3.12
407.1468506	0.19
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	478.2919
Annotation	PE(18:2(9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
134.9944458	0.15
138.9391022	0.06
150.8710632	0.02
154.9815826	0.25
165.0917053	0.12
172.8995667	0.15
174.9270630	0.10
198.0792542	0.19
206.2759705	0.07
207.3138885	0.05
215.2940674	0.07
216.0971527	0.28
231.3811646	0.06
243.3225098	0.02
245.2363434	1.23
245.8439941	0.01
253.0193481	0.04
261.4675598	0.03
263.2487793	2.39
268.7557983	0.05
287.5271301	0.03
293.1873779	0.10
295.0458374	0.06
306.6091309	0.32
307.3621826	0.03
315.3699036	0.07
319.6552429	0.04
324.3899231	0.21
327.1248474	0.02
333.3965759	0.05
337.3306580	49.19
340.9475403	0.08
343.1976929	0.04
345.4262085	0.04
347.3980408	0.12
356.1807251	0.14
358.0241089	0.07
360.1870728	0.03
361.1706543	0.17
390.1479797	0.08
414.3058777	0.06
416.6296082	0.28
417.2666321	3.92
422.4652710	0.04
424.8185120	0.06
428.8092346	0.14
435.2508850	0.66
436.0737610	0.04
442.2334290	0.08
443.3604431	0.07
445.6840515	0.03
447.3334656	0.07
450.5327759	0.08
458.0402527	0.04
460.2411804	100.00
460.9200745	0.14
468.9807434	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	630.88
Annotation	Unknow
Peak:m/z	Relative Intensity
245.0707092	0.10
246.1626892	0.02
247.2105713	0.02
248.0735931	0.03
273.0205078	1.99
289.0648804	3.56
387.0350342	1.84
402.9608154	19.10
403.5908203	0.04
475.1763916	0.04
477.0130615	0.02
500.9105835	0.25
502.9311523	0.10
515.1134644	0.37
516.8554077	100.00
517.5111084	0.15
540.9273682	0.02
542.8701172	0.05
556.9462280	0.05
567.9454956	0.02
575.1508179	0.02
583.9262695	0.30
584.8816528	0.64
586.7119751	0.14
600.8566895	0.02
602.7210083	0.28
631.4181519	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	527.1252
Annotation	3-Hydroxy-L-tyrosyl-AMP
Peak:m/z	Relative Intensity
159.8463135	0.01
161.9977722	13.48
163.7102509	0.02
199.1033173	0.06
204.9657593	0.02
216.2786255	0.02
240.2012634	0.08
249.1329956	0.02
259.2728271	0.04
262.4174500	0.02
267.0284424	0.04
277.1846313	0.07
282.3743896	0.01
302.7468262	0.03
306.2534790	0.05
311.0245972	0.02
313.5451660	0.02
322.2546387	0.01
324.0650024	100.00
333.1273804	0.03
333.7275391	0.03
346.6915283	0.03
350.8696289	0.06
361.1404419	0.03
363.2283325	0.02
364.2696533	0.45
365.2858887	0.02
368.1442871	0.05
369.2363892	0.03
376.0914917	0.07
379.2083130	0.01
385.0888062	0.07
393.2207031	0.51
394.1963501	1.50
395.3912964	0.34
397.6212158	0.05
406.1975098	0.08
410.4348755	0.02
411.2645874	0.04
428.7715454	0.10
437.3340454	0.03
446.9392700	0.10
447.9952393	0.04
451.5378418	0.04
466.2387695	0.03
472.2850952	0.20
477.7988281	0.13
480.9749146	0.05
482.7127686	0.03
490.8264771	0.07
491.4934082	0.02
496.7741089	0.04
501.2918701	0.09
505.4520874	0.07
508.6998291	0.07
509.3125000	0.18
517.2614746	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	232.0827
Annotation	Hirsutin
Peak:m/z	Relative Intensity
87.9602661	0.12
101.8924255	0.05
115.0056610	0.31
116.0177460	6.46
139.0323944	0.04
141.9767303	0.02
169.9561310	0.13
172.0043182	0.21
187.8708954	0.42
190.1476746	0.03
196.0853577	21.46
202.1331329	0.05
214.0538788	100.00
214.9939728	0.04
217.0218811	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	380.76
Annotation	Unknow
Peak:m/z	Relative Intensity
187.1526489	0.25
213.0138550	2.97
290.5977173	0.49
296.8109131	100.00
308.2091675	0.27
362.2155457	13.34
363.1337585	1.36
364.2681885	0.37
383.4226379	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	357.25
Annotation	13,14-dihydro-15-keto Prostaglandin E1-d4
Peak:m/z	Relative Intensity
116.0539703	0.48
118.787262	0.34
131.0051575	0.42
151.0351257	3.13
156.9426575	0.20
171.0765686	1.46
172.8383636	2.10
181.0919342	0.46
185.1069641	0.36
187.1585083	2.39
197.0401459	0.18
199.0199127	1.53
201.10289	0.40
213.1141052	1.79
215.2048035	2.86
217.1882324	0.60
227.2623596	0.75
228.9408569	2.88
229.848175	0.24
231.2612305	0.40
241.0691528	1.34
243.1823425	1.74
251.9403992	0.48
255.4863586	1.49
257.3132935	0.57
259.3127136	0.74
263.1614075	1.12
267.0043335	1.36
269.5129395	0.20
271.2509155	2.15
273.206543	1.21
277.4455566	0.72
278.8233643	0.42
283.1387634	1.37
285.374115	6.77
287.0884399	1.47
293.1589966	0.99
295.2412109	0.20
297.2028809	1.16
299.2587891	2.06
300.8639832	0.46
303.380127	0.40
304.8879089	0.20
311.0717468	1.64
313.2518005	2.28
315.2664795	1.56
319.211853	0.36
320.1296387	0.52
321.2493286	1.46
322.2331543	1.13
323.3520508	8.64
325.4175415	1.13
332.0506287	0.36
339.237915	100.00
339.8635864	0.70
341.2732239	17.26
348.3626709	0.34
356.2453918	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	465.07
Annotation	Unknow
Peak:m/z	Relative Intensity
135.0640411	0.21
137.0332489	0.76
148.9779358	0.06
161.9646149	0.03
164.9324799	0.22
167.1527710	0.11
195.1297302	0.25
209.0895081	0.07
212.5604248	0.04
217.0151062	0.11
223.1436768	0.31
227.2817230	0.06
229.0040588	0.04
241.0074921	11.17
257.0402527	0.14
263.3797302	0.16
272.5130005	0.18
277.9010620	0.11
283.0735474	100.00
283.6892395	0.12
301.0247498	0.10
303.4612427	0.05
305.2474976	0.02
309.1133728	1.47
327.1206665	69.03
334.8830566	0.20
341.1312561	0.67
342.4241333	0.03
344.9682007	0.28
358.3708801	0.13
361.0829163	1.37
364.4311523	0.04
366.3305054	0.06
367.1163025	0.05
369.1348572	0.15
373.3005371	0.04
377.2893982	0.44
379.1275940	36.37
381.1820984	0.07
401.1180420	0.08
402.2812805	0.10
403.1061401	0.05
408.9099426	0.04
418.2235107	0.12
421.1303406	93.16
426.4682617	0.06
427.2691040	0.11
436.4284363	0.07
446.1161804	0.05
447.1841125	4.62
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	341.0255
Annotation	(-)-Agelastatin A
Peak:m/z	Relative Intensity
193.1084442	0.61
206.9124756	0.56
208.8744202	100.00
229.9408264	0.41
277.2034302	0.19
282.0578613	0.12
321.8701477	0.10
324.1778870	1.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	267.01
Annotation	Unknow
Peak:m/z	Relative Intensity
197.1671143	0.02
222.0739899	0.09
222.7329865	0.07
223.7612152	0.03
225.8372650	100.00
226.5084076	0.12
237.2547760	0.05
239.1359100	0.01
243.2737274	3.79
243.8991547	14.30
256.9595032	0.03
265.2435913	0.01
266.4981689	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	337.0926
Annotation	1-Caffeoyl-4-deoxyquinic acid
Peak:m/z	Relative Intensity
96.8550262	0.04
99.0670319	0.02
101.2106857	0.03
109.1516113	0.03
111.1827393	0.03
112.8607788	0.12
119.0813904	5.34
126.7556229	0.09
131.0727997	0.02
143.0716248	0.04
154.0701599	0.07
154.9879456	0.31
156.1158905	0.09
162.9786224	100.00
172.9601135	5.48
174.8297424	0.02
179.2613373	0.05
187.8298340	0.02
191.0631409	8.17
199.0366211	0.25
200.1212158	0.10
204.3268890	0.05
217.1539612	0.05
229.0677490	0.05
230.1131897	0.34
231.2978821	0.04
247.1656799	0.02
249.4198303	0.01
250.1681824	0.05
263.1444092	0.03
272.1663818	0.03
274.2304077	0.67
275.2913208	0.21
291.1113892	0.12
292.4171143	0.05
293.2123413	0.15
318.3282166	0.69
319.1031494	0.20
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	265.1139
Annotation	Bluensidine
Peak:m/z	Relative Intensity
80.4439545	0.30
122.0215454	29.42
133.0016937	100.00
144.0127869	15.15
145.8899841	0.50
156.1418915	0.68
246.9311523	0.36
248.0866852	0.36
256.3559265	1.36
264.4040222	0.80
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	544.73
Annotation	Unknow
Peak:m/z	Relative Intensity
206.9360199	0.62
208.9318542	0.79
290.8491211	4.22
292.8641357	6.82
330.9411621	0.13
374.3397217	0.36
375.2562256	2.28
376.7713623	21.86
398.0966187	0.19
400.8084106	0.31
402.0112915	2.75
402.9508057	0.22
411.8441162	0.65
423.7790527	0.12
438.8397217	0.16
458.7073975	6.73
460.1232910	12.81
460.7826538	100.00
468.9057617	0.14
484.4295044	0.22
498.8328857	9.24
508.6190186	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	494.1172
Annotation	Unknow
Peak:m/z	Relative Intensity
143.1373138	0.06
144.2425995	0.02
144.9881287	0.02
146.0625000	0.03
149.9298401	0.01
155.1194305	0.01
159.9697876	0.11
164.0849915	0.06
165.3504333	0.02
167.1402283	0.14
169.0220337	0.03
171.0563202	0.01
176.9942017	0.14
179.1140289	0.36
180.1538696	0.01
186.9359589	0.05
194.9898071	0.03
197.0243530	0.05
210.2690735	0.27
211.1665649	0.02
223.1086121	0.01
231.2516327	0.03
236.2693481	0.06
238.3468933	0.02
241.1992188	0.05
249.1372070	0.02
254.2091980	1.45
265.3554993	0.02
268.1473694	0.02
269.3243408	0.02
271.0851746	0.01
272.2234192	2.91
288.1508179	1.80
289.3264160	0.04
303.9116211	0.10
306.0984497	100.00
306.9306030	0.03
318.5393677	0.04
321.9876099	0.03
323.8003540	0.01
326.1600037	0.01
328.1752625	0.03
329.2543945	0.02
331.1449585	0.11
338.0050049	0.10
346.4868164	0.03
355.4587402	0.02
357.3303833	0.11
364.2076416	0.10
364.8820190	0.04
372.3712158	0.06
373.5136108	0.01
390.2709045	0.07
393.1830750	0.04
394.1491394	0.02
396.2197571	0.04
404.9483948	0.06
406.0934143	0.04
409.2272339	0.10
412.3784485	0.08
415.0635071	0.10
416.2319641	0.02
418.9723206	0.01
421.4209290	0.01
431.2651672	0.11
433.2019653	0.09
434.1585388	0.20
435.1370239	0.01
439.5442505	0.15
445.0927124	0.01
447.3442993	0.10
448.2966919	0.01
449.2273865	0.11
450.4182434	0.19
451.1043396	0.16
457.4610901	0.22
458.0797424	0.04
463.3475342	0.03
466.3003845	0.03
475.6535034	0.30
476.3790894	0.25
476.9840698	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	295.0855
Annotation	Unknow
Peak:m/z	Relative Intensity
87.1775055	0.06
95.0369797	0.21
96.8387833	24.37
98.9847031	0.80
115.1463776	0.08
122.8844528	0.06
135.1234131	0.05
153.0611115	0.13
159.0888672	0.04
169.1236877	0.30
171.1505890	0.27
195.0482178	0.37
197.1489563	1.83
203.0279541	0.04
206.9274292	0.03
215.1089478	100.00
216.4039001	0.05
223.0960388	0.06
231.1904297	0.07
233.1441650	20.13
246.9494629	0.16
249.0360413	0.27
251.0712280	8.51
253.0998535	0.13
259.1097107	0.51
277.1604614	8.43
295.1182251	0.28
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
272.9851379	1.39
273.9002075	0.97
386.7968140	0.36
388.2034302	0.12
389.1017456	0.07
427.0029297	3.29
428.0217285	2.81
428.6937256	0.12
430.8709106	0.05
442.9558105	0.13
455.0590820	0.07
471.2675781	0.20
473.0069580	3.34
473.9850464	2.21
477.9797363	0.33
485.2763062	0.27
501.0487061	0.05
501.9346313	0.13
510.9710083	0.08
513.0390015	0.33
514.0514526	0.08
529.0737915	0.05
530.1867065	0.07
540.8942261	100.00
541.8298340	63.16
542.8303833	0.27
544.0950317	0.31
556.9110718	0.11
558.9840698	0.19
569.0267334	0.13
570.0297241	0.10
577.6746826	0.04
590.6013184	0.08
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
106.1785278	0.02
107.0586929	0.04
109.0023346	0.02
111.1023712	0.15
126.9044342	0.11
133.9954376	0.26
135.0455017	8.27
137.0986633	0.02
142.9772949	0.02
152.9699097	0.05
155.1169128	0.13
161.0056152	0.78
167.1304626	0.03
173.0990295	2.61
176.3103333	0.04
179.0131836	42.18
179.6500702	0.03
188.7169952	0.02
191.0104523	100.00
219.1735840	0.07
232.9072266	0.10
249.0192566	0.04
255.1793518	0.04
262.9291992	0.04
271.2885132	0.06
299.1947021	0.04
307.1306763	0.06
309.0344238	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	478.2918
Annotation	PE(18:2(9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
173.0338593	0.13
203.2984619	0.05
215.9515076	0.05
245.4567719	0.23
263.1456299	0.11
272.8572388	0.07
286.5778503	0.08
294.3204956	0.12
306.1329651	0.03
306.8276367	0.03
315.3047485	0.14
325.3177795	0.06
337.2547607	100.00
343.2495117	0.19
380.4923401	0.27
391.4964905	0.17
397.3382874	0.05
404.6236877	0.13
411.3120422	0.10
417.0553589	0.27
460.3372803	5.84
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	238.02
Annotation	3-{[(2E)-4-Amino-4-oxobut-2-enoyl]amino}-L-alanine
Peak:m/z	Relative Intensity
135.9380493	0.04
137.0103912	0.09
148.0822296	0.13
154.0654907	100.00
164.1828308	0.04
170.3002319	0.06
191.8972321	0.65
194.0263977	0.81
195.8957672	0.11
209.9537354	0.13
219.9895325	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	959.2812
Annotation	1,2,2'-Trisinapoylgentiobioside
Peak:m/z	Relative Intensity
270.9342041	0.01
272.2579956	0.06
273.2512512	0.08
274.2313843	0.04
275.2684326	0.11
277.0783081	0.45
278.3252869	0.04
281.3501892	0.02
287.2025452	0.24
289.1875610	3.40
290.0273743	0.16
294.2410278	0.06
295.2083130	0.16
296.5464172	0.02
298.4190063	0.02
305.2138367	0.08
307.3337402	0.16
313.3136902	0.10
314.3438721	0.02
325.2763672	0.20
326.0869751	0.01
331.1538086	0.70
332.1447449	0.09
367.1891479	0.99
368.1871948	0.02
370.4372864	0.02
371.2521667	0.04
380.1183472	0.03
385.1947632	1.30
386.1348877	0.01
395.3145142	0.12
405.2265930	0.04
409.1649170	0.04
411.1904297	0.07
413.1201172	0.03
425.1599121	0.09
427.2309570	2.80
428.0552979	0.26
429.3336182	0.14
439.3405151	0.07
443.4671021	0.06
449.3719482	0.03
450.7009888	0.05
453.1743774	0.02
454.5287476	0.04
457.3124390	1.65
458.4265747	0.06
463.2251587	0.05
465.4367065	0.02
467.2623291	0.06
469.2052002	3.33
470.3810425	0.19
471.0172119	0.10
473.6442261	0.02
479.4324341	0.04
482.3706665	0.02
483.2393188	0.10
485.4885254	0.11
487.2133179	2.03
487.9104004	0.12
493.2398682	0.45
494.3472290	0.02
495.1237793	0.03
497.2933960	0.69
498.3519897	0.01
511.2365112	10.24
512.2896729	0.92
515.4687500	0.22
516.2327881	0.12
529.2531738	10.06
530.2744751	1.27
535.4682617	0.05
537.1759033	0.05
547.0432129	0.03
551.4435425	0.04
555.2510376	0.08
591.1229858	0.11
592.3059082	0.02
611.5510254	0.02
633.2549438	0.30
634.4124146	0.03
645.3065796	0.02
647.2567139	0.06
649.5165405	0.09
657.8167725	0.01
661.2468872	0.01
662.7431030	0.06
663.3703003	0.57
664.1746826	0.02
667.8353271	0.04
674.0062866	0.05
675.2044067	0.25
678.6604004	0.02
683.8698120	0.02
690.0746460	0.01
691.6659546	0.13
693.3269653	0.87
694.3452148	0.13
696.0693970	0.04
699.4011230	0.09
705.3622437	0.06
707.3913574	0.01
708.3727417	0.01
709.4137573	0.07
717.3468628	1.42
718.4153442	0.19
721.2862549	0.55
729.4786377	0.01
735.2399292	100.00
736.2959595	12.23
737.4109497	0.01
749.3323364	0.07
750.1508179	0.01
752.5455322	0.04
753.1962891	2.51
754.2984009	0.40
762.4705811	0.03
767.0856934	0.04
789.0876465	0.03
806.0816040	0.01
808.1542358	0.01
843.6426392	0.02
847.2926025	0.04
863.6301880	0.03
899.2770996	0.09
900.1368408	0.01
915.3824463	0.11
923.0521240	0.01
931.4373169	0.04
941.2073364	0.28
942.3329468	0.25
961.8206177	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	376.81
Annotation	Unknow
Peak:m/z	Relative Intensity
208.9653320	3.46
212.9960938	0.14
215.1159821	0.12
226.9748840	0.28
290.7935181	6.35
292.8133850	100.00
293.5082397	0.05
314.4904480	0.52
331.0919189	1.08
340.9562988	0.38
345.2430420	0.40
358.8504333	0.26
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	421.1648
Annotation	Ugonin P
Peak:m/z	Relative Intensity
125.0911789	0.02
130.1716766	0.20
146.0794067	0.18
147.0263672	0.09
164.9314117	0.01
172.3268738	0.08
189.0049133	0.08
215.1807556	0.05
217.2041168	0.59
218.3735962	0.07
229.0288696	0.01
243.6045532	0.01
259.2556763	0.13
277.1478577	100.00
291.2602234	0.07
319.1808472	3.06
323.0610962	0.03
325.1688232	0.04
328.9949036	0.01
334.2486572	0.07
359.1460266	0.40
362.1968994	0.03
385.3841553	0.04
391.1582947	0.06
403.1741943	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	579.0694
Annotation	Volkensiflavone
Peak:m/z	Relative Intensity
182.0643921	0.20
185.1562500	0.33
202.3230591	0.19
212.8386078	0.31
218.0175781	0.20
220.3179932	0.11
235.9899597	0.10
243.0467987	0.34
247.8773041	0.14
254.1636200	0.18
280.7931519	0.27
284.7570801	0.54
291.9646912	0.26
318.0283813	100.00
326.8265381	0.37
334.1973877	0.31
341.3124390	0.17
348.2699585	0.50
350.2055664	1.01
357.3380127	0.13
365.3964233	0.52
376.4478760	0.43
378.2207031	0.16
379.2112427	0.33
384.9775391	0.45
386.1641846	0.41
387.0975342	2.46
391.4252930	0.42
397.1010742	14.83
397.7485352	98.62
398.4235229	0.30
401.1667480	0.23
411.3699341	0.34
413.2998657	0.18
417.7646484	0.19
426.8778076	0.62
427.4978638	0.47
429.2716064	0.38
431.2529297	1.12
440.5973511	0.18
443.3035278	0.85
445.7817383	0.78
447.9549561	0.35
448.6172485	0.16
449.2899170	0.50
450.1552734	0.57
460.3150024	0.69
472.1834106	0.67
473.2211914	0.12
474.2885132	0.17
480.3235474	0.78
481.0300293	0.26
494.0404663	0.31
498.4441528	0.49
500.5174561	0.34
534.2470093	0.25
543.2164307	0.97
544.5972290	0.25
559.8961792	0.58
561.4957886	2.23
570.1043701	1.48
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	325.0322
Annotation	Gliotoxin
Peak:m/z	Relative Intensity
96.7968826	100.00
113.9898987	0.17
128.8156128	0.23
143.0499573	0.11
176.0085754	0.24
183.0373230	1.82
185.1100159	0.16
193.0044403	0.07
195.8385010	12.44
197.0704651	0.62
207.3036499	0.39
210.0995178	0.13
225.7773132	0.05
231.1635742	0.25
255.2565002	0.29
257.4537354	0.07
263.2643127	0.41
266.6410217	0.16
267.3544922	0.04
279.2189636	0.28
280.7911987	0.74
281.3974915	0.63
287.0567017	0.05
289.4721375	0.45
297.1118774	0.08
305.1501770	0.52
306.3948975	0.75
307.2198486	3.85
307.8611450	0.06
309.2199097	0.90
310.1977539	0.19
320.9223328	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	1024.37
Annotation	Unknow
Peak:m/z	Relative Intensity
295.3088074	0.07
297.2995605	0.11
298.0349731	0.16
321.3620605	0.12
327.1336670	0.24
331.2297668	0.19
332.4016418	0.07
336.0988770	0.11
339.0136719	0.11
341.5252686	0.19
359.1172485	0.23
368.3342590	0.17
380.2575073	0.37
391.5675659	0.29
398.4309692	0.56
399.4075623	0.08
400.2628174	0.16
404.0397949	0.36
410.2901611	0.13
411.4752502	0.43
415.3712158	0.31
426.0370178	0.12
430.3905029	0.15
438.0978394	0.26
438.7084351	0.43
448.3229675	0.12
454.3768921	0.11
466.8012695	0.17
467.8869019	0.15
470.1219482	0.93
470.9781189	0.11
475.7283325	0.07
480.4574890	0.29
482.8845215	0.27
485.5929871	0.12
492.0462646	0.11
492.7931519	0.08
498.5324707	0.41
506.4293823	0.09
509.4170532	0.14
512.2183838	0.54
520.2401733	0.34
522.4548950	0.34
525.6229858	0.07
530.3504028	0.08
531.6326904	0.14
539.9073486	0.33
541.2365723	0.09
542.5206909	0.31
543.7874146	0.20
545.9873657	0.18
554.5212402	0.05
555.5339355	0.28
563.1343994	0.23
567.9321899	0.23
570.2581787	0.31
574.4182739	0.14
575.4492188	0.08
576.9831543	0.29
580.0101318	0.12
589.2069092	0.08
593.0893555	1.02
594.6693115	0.08
599.1787720	0.59
612.8271484	0.10
617.4887695	0.25
618.5633545	0.30
627.0075073	0.16
628.3848877	0.09
630.8837280	0.34
631.7595825	0.55
636.1028442	0.64
638.3519287	0.41
640.5317993	0.42
642.7424927	0.11
645.3663940	0.07
648.3997803	0.38
649.4642334	0.29
652.2662354	0.19
653.3483887	0.25
654.7170410	0.50
655.8698120	0.61
656.5910645	0.16
662.3767090	0.33
663.5714111	0.47
665.6677856	0.11
666.2716064	0.39
667.4212646	0.23
670.4812012	1.49
671.1965332	0.18
673.7526855	1.34
675.5310059	0.56
683.4437256	0.75
684.4942627	1.21
685.3731689	0.33
686.4475708	0.82
697.6683350	0.92
698.9577026	0.26
702.3018188	0.29
704.1695557	0.72
707.3833008	0.24
708.4969482	0.15
709.5117188	0.15
710.1267700	0.49
712.4922485	0.55
714.6220703	0.27
716.8433838	0.11
720.5930176	0.10
725.4388428	0.66
727.1850586	0.50
728.2580566	0.78
729.4939575	0.28
737.3082275	0.39
738.5673828	0.47
741.9209595	0.08
748.3458252	0.12
750.8535156	0.45
752.9985962	1.55
753.9992065	0.58
755.3510742	1.41
756.3806152	0.63
757.9464722	0.58
763.2706299	0.38
763.8903809	0.25
764.9089355	0.40
767.5194092	0.50
769.5672607	0.26
771.5830078	0.17
772.5652466	0.06
773.4858398	0.53
774.6735840	1.82
775.3081055	1.32
776.3869019	0.54
778.5928955	0.10
779.5751343	0.90
785.1319580	1.43
786.5711670	0.42
787.8508301	0.51
790.4293213	0.20
792.8223877	0.35
795.8193359	0.30
800.4134521	0.33
802.0610352	0.72
804.6715088	0.60
806.1751709	0.44
807.3699951	0.30
807.9783936	0.09
809.3699951	0.22
813.3857422	0.15
814.7879639	0.32
816.2119141	0.90
817.3557129	1.54
818.0064697	1.39
819.9545898	1.17
820.7352295	0.36
821.8857422	3.33
822.7308350	0.16
823.5100098	0.21
826.5032959	1.19
827.5091553	1.07
828.5817871	0.43
829.5727539	0.71
830.7037354	0.41
831.5581055	0.80
832.2019043	0.59
835.2073975	2.36
837.3496094	0.08
838.4273682	0.41
839.3542480	0.12
840.8796387	1.87
841.6085205	0.21
842.5382080	0.49
843.3983154	0.65
849.9350586	0.81
851.9019775	0.52
854.5849609	0.29
855.6243896	0.42
856.5826416	0.48
857.8164062	6.19
858.6104736	0.50
863.2604980	0.26
864.7758789	0.32
869.5637207	1.14
871.0830078	0.27
872.0423584	2.74
873.8804932	0.53
876.1198730	0.25
877.0662842	0.48
879.3640137	1.11
880.8239746	0.76
881.5000000	0.09
882.7689209	0.07
883.7474365	0.23
884.6984863	1.36
886.8298340	0.15
888.2700195	5.46
889.1516113	0.80
890.6574707	1.11
891.2841797	2.83
892.4783936	1.50
893.8023682	4.03
894.6638184	2.64
895.5917969	0.88
897.6176758	3.90
898.3187256	0.47
901.6778564	0.64
903.0510254	0.20
908.1953125	0.13
911.5693359	0.96
913.4089355	0.22
916.7724609	0.74
918.0413818	0.26
920.6317139	0.77
921.4748535	1.69
922.4776611	0.47
924.3717041	0.23
925.3266602	0.56
926.5886230	2.10
929.6966553	0.20
930.7155762	1.47
931.5826416	9.58
932.2515869	2.68
933.8854980	2.04
935.5028076	0.41
937.0468750	0.70
938.0310059	0.45
939.5325928	14.51
940.5629883	5.39
941.3945312	1.27
945.3939209	3.26
946.2601318	1.62
947.2136230	0.13
948.2354736	0.88
948.8481445	0.04
949.5302734	1.98
950.2209473	0.09
952.1573486	0.26
954.5563965	0.28
956.6433105	0.92
960.9079590	1.78
962.0292969	0.26
963.6979980	0.17
967.1560059	4.42
967.8642578	0.66
968.9487305	0.31
970.2348633	0.98
971.7214355	0.28
974.7756348	6.61
975.7236328	0.84
977.4378662	0.07
979.4379883	1.04
981.1286621	0.51
981.9141846	1.27
983.1605225	0.14
985.4038086	0.21
986.4577637	0.96
988.9006348	1.85
990.8989258	0.95
991.5517578	0.66
993.2972412	1.04
994.3090820	0.05
995.0478516	0.58
995.7946777	0.82
996.8684082	1.58
997.8227539	0.68
999.9783936	0.21
1001.1027830	0.98
1003.2365720	5.09
1004.2503660	4.24
1005.2694090	3.71
1006.6098630	2.85
1007.3897710	1.29
1008.0991210	4.20
1009.4360350	1.67
1010.2841800	3.21
1011.3840330	0.95
1024.3028560	0.06
1026.8715820	0.26
1027.5778810	0.11
1029.1264650	0.19
1037.5195310	0.23
1038.6361080	1.33
1039.8721920	0.38
1041.1917720	0.18
1043.1798100	3.65
1044.1718750	0.86
1046.1687010	0.42
1047.0568850	0.62
1048.2091060	3.39
1050.8953860	2.05
1051.8712160	0.78
1052.7850340	0.19
1053.7817380	1.13
1054.4672850	2.99
1055.2537840	1.67
1056.3498540	0.09
1057.0878910	0.16
1058.6481930	0.25
1059.7890620	1.17
1062.3762210	1.24
1063.0384520	0.11
1064.0275880	0.86
1064.6984860	0.09
1066.6064450	0.97
1067.5249020	1.89
1068.3594970	0.12
1069.4709470	0.45
1071.3359380	4.05
1072.0633540	7.60
1072.7080080	0.59
1074.7650150	8.51
1075.8702390	0.21
1076.9682620	0.38
1078.4698490	1.70
1080.7281490	1.91
1081.3900150	0.29
1083.7907710	0.80
1084.7497560	5.19
1085.6385500	1.79
1087.8526610	1.25
1089.2741700	3.81
1090.0213620	2.52
1091.2757570	2.96
1091.9633790	0.20
1093.6430660	0.79
1094.9930420	9.47
1095.7856450	0.42
1096.6235350	0.31
1097.9010010	1.94
1098.6608890	0.53
1099.6287840	0.41
1102.7541500	1.64
1104.4687500	1.53
1105.4781490	1.85
1106.5577390	1.36
1107.7258300	0.97
1109.1885990	8.47
1110.6038820	0.65
1111.5512700	0.63
1113.2935790	1.29
1115.6663820	2.21
1116.7531740	3.41
1117.6828610	3.38
1118.4724120	0.49
1119.0942380	0.22
1120.3985600	0.26
1121.9880370	3.47
1122.6959230	0.40
1123.9338380	2.23
1124.8342290	0.64
1126.5051270	0.23
1128.5507810	4.66
1129.3453370	0.87
1130.1322020	0.73
1130.9805910	1.08
1132.4957280	1.41
1133.5650630	0.21
1135.0017090	4.41
1135.6156010	0.17
1137.5859380	0.09
1138.7445070	0.48
1140.4266360	0.51
1141.8868410	1.63
1143.2436520	0.21
1144.2264400	2.34
1147.0397950	6.01
1147.7800290	0.53
1149.2254640	0.29
1150.4771730	3.10
1151.4024660	0.68
1153.1890870	9.16
1153.9254150	4.86
1154.8017580	0.27
1155.7116700	1.50
1157.0402830	8.76
1157.7592770	0.05
1159.0971680	1.39
1160.7746580	14.63
1161.8521730	1.44
1162.6887210	0.11
1163.5849610	0.09
1164.1900630	0.33
1167.1495360	1.00
1169.4562990	0.94
1170.3634030	0.54
1171.4591060	0.41
1172.7385250	1.30
1173.5356450	0.92
1174.4251710	1.44
1175.7772220	0.75
1176.6564940	0.37
1179.4550780	0.68
1180.1528320	0.26
1181.1845700	0.48
1183.0339360	2.02
1183.8432620	0.38
1185.4489750	0.56
1186.3823240	0.18
1187.3964840	0.75
1188.6625980	0.67
1190.0567630	0.84
1191.0107420	0.92
1192.6119380	0.35
1193.8044430	0.24
1194.8149410	0.93
1195.9471440	0.98
1198.5781250	0.31
1199.6041260	0.25
1200.4583740	1.05
1203.7460940	2.79
1206.4770510	0.62
1209.4932860	0.53
1211.7607420	0.13
1213.5340580	1.06
1216.4926760	2.09
1219.1173100	0.85
1219.9227290	0.13
1222.6094970	1.13
1223.9160160	0.72
1224.7420650	0.77
1225.5667720	0.49
1226.6905520	0.72
1230.0214840	0.40
1230.7700200	0.28
1231.3981930	0.07
1232.6416020	0.78
1233.6462400	0.97
1234.4692380	1.09
1236.5024410	0.61
1237.2169190	0.07
1238.4831540	1.68
1242.1237790	4.36
1242.8444820	0.50
1243.6871340	0.27
1245.0136720	0.11
1245.7012940	9.69
1246.7495120	0.08
1249.4025880	0.28
1250.7309570	1.67
1251.5495610	0.26
1252.5963130	0.88
1253.5775150	0.41
1255.3476560	1.79
1256.2404790	0.58
1257.8369140	0.18
1260.3076170	1.02
1262.9870610	0.41
1264.6992190	0.69
1265.5529790	2.10
1266.5306400	0.83
1267.6877440	0.37
1268.4482420	0.35
1269.4450680	1.06
1270.1391600	0.75
1271.0979000	0.38
1273.1868900	0.24
1276.2832030	0.22
1278.1772460	0.70
1282.6516110	4.46
1283.3166500	3.09
1284.2951660	1.27
1285.6030270	4.82
1286.8461910	10.97
1287.7358400	1.07
1288.6096190	0.46
1290.4647220	0.51
1291.4793700	0.43
1292.2597660	0.25
1294.2281490	5.54
1295.1818850	2.20
1295.9705810	0.28
1297.0618900	0.18
1298.4764400	0.78
1299.9731450	2.28
1300.6239010	0.07
1304.6329350	0.50
1307.0817870	0.49
1308.9260250	0.09
1313.6016850	0.27
1316.7149660	0.29
1317.7121580	0.13
1319.0690920	1.38
1322.9676510	0.37
1324.0567630	1.24
1325.3781740	1.22
1326.4886470	1.35
1327.2864990	0.98
1331.5684810	1.47
1332.9132080	1.14
1333.8028560	0.52
1335.5395510	0.65
1336.9921880	1.11
1337.9510500	3.07
1339.1582030	0.17
1339.7918700	0.77
1340.4212650	0.39
1341.5124510	1.49
1342.2149660	0.80
1343.1473390	0.27
1343.7755130	0.54
1345.7231450	0.10
1347.9764400	1.76
1348.9797360	0.55
1349.8472900	0.10
1352.4545900	0.36
1354.8081050	0.30
1358.7154540	3.36
1364.7764890	2.19
1365.7211910	0.74
1366.8511960	0.11
1368.6236570	0.65
1371.2037350	0.23
1373.1254880	0.07
1373.8905030	0.10
1375.4860840	0.52
1379.6763920	1.81
1380.5993650	1.72
1381.4691160	0.66
1384.4368900	1.24
1385.8656010	0.70
1387.5664060	0.56
1390.7756350	0.36
1392.4857180	0.16
1397.5275880	0.38
1399.8135990	0.51
1400.9205320	0.95
1401.8966060	0.27
1404.8288570	0.19
1406.2381590	0.83
1413.8536380	0.26
1418.1058350	0.79
1420.1503910	0.33
1421.6112060	0.12
1422.6169430	0.85
1424.0039060	0.53
1426.5750730	0.93
1432.4290770	0.35
1433.0493160	0.08
1435.9719240	0.15
1440.9912110	0.17
1443.1951900	0.14
1444.9224850	0.58
1449.5791020	0.21
1452.7003170	0.65
1453.8221440	0.23
1455.3724370	0.27
1456.8896480	0.19
1462.1336670	0.95
1471.7843020	0.37
1477.9453120	0.23
1483.8686520	0.67
1486.7846680	0.25
1489.7357180	0.66
1493.3562010	0.11
1495.9864500	0.32
1498.5573730	3.43
1499.4036870	0.07
1504.8554690	0.59
1505.9464110	0.13
1508.1168210	0.38
1509.2193600	0.17
1516.9805910	0.40
1526.3790280	0.09
1527.4055180	0.12
1531.4991460	0.82
1543.5728760	0.41
1544.6909180	0.21
1547.4820560	0.43
1548.2781980	0.20
1552.7227780	0.27
1557.3648680	0.32
1558.8753660	0.05
1560.7772220	0.46
1571.0667720	0.42
1576.7337650	0.26
1579.6351320	0.13
1581.9916990	0.25
1583.7601320	0.27
1593.8055420	0.24
1595.0888670	0.24
1597.9064940	0.17
1600.4031980	0.46
1614.4539790	0.33
1622.8487550	0.23
1630.7695310	0.21
1640.7567140	0.13
1642.5198970	0.38
1654.7473140	0.28
1668.4421390	0.35
1682.3195800	0.15
1694.0681150	0.30
1695.8680420	0.17
1696.9097900	0.26
1701.1950680	0.90
1704.9406740	0.43
1706.4079590	0.27
1708.9475100	0.12
1711.3933110	0.29
1712.9693600	0.12
1722.8809810	0.20
1729.3508300	0.56
1737.9468990	0.22
1741.9483640	0.46
1742.9229740	0.54
1760.3210450	1.43
1774.9752200	0.56
1775.9271240	0.12
1776.9421390	0.05
1782.5032960	0.33
1793.6859130	0.54
1795.1173100	0.24
1795.7813720	0.27
1801.8741460	0.12
1805.8035890	0.11
1829.5480960	0.06
1851.6981200	0.50
1861.9133300	0.12
1864.9259030	0.92
1869.5887450	0.30
1871.5633540	0.30
1872.2149660	0.24
1875.8104250	0.17
1878.3073730	7.24
1884.8770750	0.19
1890.1594240	0.42
1890.9152830	0.13
1896.6887210	0.32
1907.0777590	0.37
1908.5811770	0.98
1909.8265380	0.20
1917.9328610	17.67
1919.3363040	0.49
1920.0941160	0.50
1926.0716550	0.68
1932.4530030	0.37
1935.0543210	0.09
1938.9738770	6.48
1942.0823970	0.25
1947.1052250	0.54
1953.6145020	0.11
1959.9246830	2.66
1960.8370360	0.30
1962.4517820	0.07
1967.8812260	2.95
1980.3870850	0.50
1986.1451420	0.64
1993.2352290	1.39
1994.8420410	100.00
1998.9813230	0.28
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
118.8449326	0.16
129.0917358	0.08
130.7840881	0.09
163.6822968	0.14
168.9286194	0.05
172.9021301	1.46
180.1057281	0.57
184.9749146	0.12
191.0541077	100.00
202.0893402	0.06
213.0435028	0.70
224.4309692	0.10
225.1748047	0.15
240.5771484	0.57
254.9172974	0.36
272.8991394	0.55
288.9837341	0.41
298.9873047	0.30
306.1115723	0.48
309.1079407	0.21
315.0140991	0.17
317.0198364	3.00
323.1982727	0.20
341.1242065	0.22
351.2570496	0.05
356.3150940	0.05
359.0600586	0.93
360.4423523	0.23
374.3336792	0.09
376.3444824	0.51
377.5396423	0.60
385.0179749	0.32
403.0052185	8.09
403.6721191	0.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	182.98
Annotation	Unknow
Peak:m/z	Relative Intensity
92.9651642	0.03
111.1443787	0.07
112.0523529	0.02
123.2952576	0.06
137.8911743	0.03
138.9659729	0.39
140.1180267	0.12
141.8367310	100.00
152.8106232	0.01
153.5402374	0.07
155.0419617	0.12
155.7931366	0.01
159.7446747	1.97
161.8202972	0.09
162.6614227	0.01
164.3856354	0.03
165.1448822	0.02
170.9257660	0.06
183.0433655	0.22
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
132.2346191	0.03
159.1680298	0.14
177.1184540	0.01
188.0469208	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	558.1
Annotation	Unknow
Peak:m/z	Relative Intensity
162.0092010	0.73
162.9645996	0.31
164.0179138	0.77
217.1582642	0.04
231.0659332	0.06
270.8103638	0.12
330.3316650	0.11
331.0984497	0.16
358.2437134	0.09
359.2728271	0.08
375.9094238	0.11
392.1976929	0.14
395.3034058	0.12
410.0498657	76.32
411.0663452	42.36
412.0206909	100.00
442.0291138	0.29
471.5451050	0.07
494.1918945	0.45
521.4802856	0.09
523.5512695	0.08
532.0411987	0.32
534.3493652	0.17
540.4634399	0.05
548.7431030	0.18
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	500.1406
Annotation	Unknow
Peak:m/z	Relative Intensity
143.3384399	0.04
144.3076630	0.03
155.2834015	0.06
160.0848083	0.03
160.9230347	0.06
162.0701599	0.03
169.0647125	0.40
172.1752319	0.15
174.0760803	0.08
176.0083923	19.60
177.0808258	2.95
183.9419250	0.05
184.8591614	0.07
186.1071167	0.07
188.0700378	0.03
190.1342468	0.15
200.2766724	0.04
211.0598297	0.14
216.4165955	0.07
218.1827698	3.91
219.1558685	0.89
228.2669525	0.04
231.1720581	0.04
248.0360107	0.54
249.0893555	0.06
254.1947632	0.05
259.3509827	0.03
273.1760864	0.07
278.1755066	2.71
279.1501465	0.73
294.1064148	0.08
304.8276672	0.18
306.4220276	0.04
320.2156677	0.15
321.4723816	0.07
322.3692627	0.11
324.5894775	0.03
336.0219116	0.04
338.1674805	100.00
339.2072144	30.29
341.2735291	0.05
343.0866089	0.06
348.1275635	0.05
350.1716309	0.13
351.0893555	0.06
352.2356262	0.09
357.3697205	0.03
367.0241699	0.10
370.4776611	0.05
380.1849365	18.61
381.2603455	5.88
390.3555298	0.02
392.4917908	0.26
396.0270081	0.02
403.0944824	0.17
410.2316895	2.73
411.2020874	0.91
421.4143372	0.03
422.0641479	0.10
423.0312805	0.03
425.0340271	0.10
426.9037781	0.06
440.2238464	25.43
441.2947083	10.64
452.4576721	0.05
455.1856384	0.19
456.0144043	0.31
463.7930603	0.06
465.2848816	0.07
474.1188049	0.11
482.2566528	0.48
483.3765564	0.32
492.0005188	0.13
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	520.266
Annotation	PS(18:3(6Z,9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
148.8326111	0.09
157.2945557	0.05
160.8840332	0.14
162.9936676	0.07
167.1756287	0.06
168.0992889	0.12
171.2085724	0.12
173.1085510	0.09
197.0417328	0.13
199.4234619	0.05
201.1412354	0.23
213.0529785	0.10
215.3260956	0.06
221.2586823	0.02
224.1693115	0.13
226.0697021	0.05
235.2079468	0.15
241.9707336	0.16
243.1363525	0.38
253.1717224	0.08
259.9825439	0.13
261.2116089	0.30
267.1514893	0.05
287.2162476	0.04
291.0176086	0.15
293.4712524	0.02
299.5015869	0.04
305.2399292	0.11
317.4081421	0.24
320.8993530	0.10
322.6343384	0.03
335.2905273	100.00
335.9212646	0.19
348.2655640	1.09
349.2715454	0.12
360.6170044	0.03
363.3439331	0.03
364.6455688	0.09
365.9030151	0.32
373.2512817	0.06
380.7086182	0.20
390.0148926	0.12
396.7844849	0.05
400.8681030	0.05
404.1036377	0.06
414.6712036	0.14
415.3222046	1.77
417.8229370	0.15
421.2362671	0.16
422.0846558	0.50
422.6922607	0.03
424.9290161	0.05
433.2846069	0.29
437.5471802	0.15
445.3964844	0.21
446.4025879	0.04
448.9097900	0.06
449.8069458	0.15
456.4581299	0.02
464.4002686	0.22
471.2182007	0.06
474.3553467	0.10
478.1419067	0.04
482.3632812	0.06
483.4027710	0.08
485.0897217	0.06
488.5485229	0.02
502.2409668	14.57
503.4001465	0.19
504.1060791	0.04
505.4348755	0.10
516.1133423	0.03
523.2731934	0.10
527.2790527	0.08
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	206.89
Annotation	Unknow
Peak:m/z	Relative Intensity
122.7767029	100.00
128.9522095	0.09
132.7391357	0.07
178.7631989	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	431.192
Annotation	(6R)-9,10-Dihydroxy-4,7-megastigmadien-3-one-9-O-beta-D-glucopyranoside
Peak:m/z	Relative Intensity
124.8130417	0.01
129.0084839	0.03
137.1650391	0.08
138.1838226	0.07
142.9379425	0.22
150.9391785	0.02
153.0988464	1.21
154.1725769	0.04
159.0646667	0.23
161.1152344	1.45
162.2702026	0.02
179.0333252	0.42
187.0697479	0.02
195.1133118	0.06
205.0917053	1.81
206.1088715	0.17
223.0178833	3.29
224.0894318	0.17
226.2207184	0.02
236.7811890	0.01
285.1401672	0.04
301.1536255	0.08
307.2388306	0.05
313.2147827	0.03
342.4376831	0.01
344.3108826	0.08
383.3106995	0.02
385.1853943	100.00
386.1738281	4.99
387.4428101	0.19
396.3643188	0.07
403.2245789	0.02
411.2341614	0.04
413.5525208	0.19
414.2496948	0.03
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
91.80267334	1.25
103.0774689	2.23
114.9993286	0.43
116.4489136	0.80
128.9450836	6.24
129.6808929	1.25
140.9671478	0.85
147.0023956	2.69
151.0559235	100.00
151.8921661	3.80
155.2127838	1.41
164.9936066	1.79
166.1232147	3.29
167.0535889	7.89
168.105957	1.38
169.1357117	1.23
179.1477814	1.37
182.1246338	1.94
183.2076416	1.24
185.0762787	2.89
186.0712738	3.73
194.0346222	0.94
196.4073334	1.51
197.184494	3.05
210.2145996	0.64
211.22789	1.42
217.4447327	0.82
225.1160736	9.74
226.0413208	2.18
235.0301514	6.38
237.9790192	17.31
239.0622559	1.32
253.0920868	71.29
254.103714	5.52
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	205.0507
Annotation	Anhydrosepedonin
Peak:m/z	Relative Intensity
98.0925903	0.02
108.2798309	0.02
133.9917450	0.13
138.2091522	0.01
146.8032074	0.09
158.2602386	0.02
159.9562836	0.01
161.1355896	0.05
162.1672821	0.03
163.1026306	0.25
175.1751251	0.03
177.0653229	0.26
186.1227264	0.04
187.0771027	0.99
189.9517212	100.00
205.0827026	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	532.8748
Annotation	Unknow
Peak:m/z	Relative Intensity
158.9574280	0.33
174.5448914	0.47
175.1783752	0.24
198.6187744	0.15
201.0408936	0.16
215.0235596	0.06
229.1493378	0.13
245.0094452	0.28
249.2558899	0.07
273.0133057	3.55
274.1282959	0.56
275.0958862	0.14
289.0319824	13.85
291.0838623	0.09
304.9295044	4.59
346.9248047	0.19
377.1205444	0.05
386.9690552	14.42
387.9886475	1.67
389.1195679	0.32
402.9077148	7.34
403.9008789	0.14
415.1723022	0.07
415.9572144	0.11
418.9214478	100.00
441.3368530	0.04
442.7141113	0.39
443.4442749	0.07
446.9832764	0.10
456.3380737	0.04
458.9475708	0.41
486.4937134	3.95
487.1140747	2.81
488.8084717	0.19
490.8353882	0.49
505.1762695	0.38
506.0683594	0.09
514.0423584	0.53
515.0095825	0.78
522.8963013	0.32
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	476.278
Annotation	PE(18:2(9Z,12Z)/0:0)
Peak:m/z	Relative Intensity
139.8838806	0.07
149.1667938	0.02
153.0107574	0.13
165.1197510	0.01
195.9775238	0.08
211.2814941	0.03
214.1357117	1.47
223.9425659	0.01
234.2226562	0.03
247.3766327	0.01
251.9466248	0.02
254.1619263	0.01
256.0745850	0.03
257.2408142	0.06
261.2254944	0.14
272.3367310	0.01
279.2726135	100.00
280.2431030	0.02
284.4738770	0.02
289.0969238	0.02
307.2400513	0.05
319.3316650	0.03
331.0680237	0.05
357.5109558	0.01
381.2194214	0.01
387.9830627	0.02
395.3055115	0.02
396.9433289	0.01
403.5553589	0.01
408.4121399	0.03
410.5155945	0.02
412.2900696	0.02
414.3816833	0.03
415.7863159	0.05
416.5950623	0.03
429.4587097	0.03
430.5947571	0.02
431.2962341	0.05
431.9193115	0.02
439.3466187	0.02
440.5777588	0.05
441.4870911	0.03
456.3356018	0.02
457.7810669	0.40
458.3937988	0.05
459.0694885	0.12
462.2732239	0.04
475.5092468	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	611.1121
Annotation	Cefpiramide
Peak:m/z	Relative Intensity
184.9278107	0.05
202.0807800	0.68
202.9441376	0.05
244.1790466	0.05
262.0711060	0.05
304.4339600	0.02
307.3349609	0.01
328.1157227	0.03
333.7279053	0.02
337.9312744	0.03
345.9275513	0.02
363.0567627	0.79
364.1450195	0.09
398.2690430	0.03
406.2885742	0.05
407.9475708	0.24
409.0345459	0.01
445.6365356	0.08
449.3350830	0.08
474.3043213	0.04
480.4976807	0.04
482.1650391	0.01
492.4421997	0.02
493.2493896	0.07
525.3043823	0.69
538.5979614	0.01
549.0858765	0.10
567.1880493	100.00
568.1797485	6.13
582.4934082	0.02
593.3248291	0.06
594.3931274	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	409.1855
Annotation	Vernoflexuoside
Peak:m/z	Relative Intensity
132.2486115	0.03
144.1661072	0.12
146.0824127	1.51
159.0362244	0.19
170.1572113	0.11
186.2009277	0.03
188.0561066	23.44
202.9584045	0.08
205.0021973	100.00
207.1095581	0.01
249.1360779	0.03
260.7628784	0.02
277.9990845	0.02
297.5594177	0.02
307.5617676	0.04
343.3972473	0.05
346.4382324	0.05
364.1832581	0.02
388.0881042	0.08
391.1235046	0.13
392.2470398	0.19
394.0148926	0.10
408.4309387	0.03
409.4735107	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	330.1542
Annotation	Cypendazole
Peak:m/z	Relative Intensity
109.1015015	0.06
121.0152130	0.47
125.0290375	0.08
130.0120697	1.08
148.1603699	0.21
155.0130310	0.58
164.9830322	4.52
182.9753113	15.72
187.1477661	0.29
200.8869171	0.86
214.1211853	0.28
223.1269836	0.22
225.3276062	0.21
227.8479919	0.49
238.3095398	0.14
242.3936768	0.21
250.7865906	0.35
253.0794373	0.23
253.8830261	0.43
259.2835388	0.21
260.1559448	0.20
263.3001099	0.35
266.0835876	2.59
267.0846558	0.25
269.1055298	0.21
270.0474548	0.66
281.2449341	0.28
284.1087036	12.60
285.4770508	0.31
287.8961792	0.31
289.2193604	0.22
294.0344849	1.26
295.0601196	0.42
297.2687378	0.15
299.2691040	0.13
301.2369690	0.12
302.5083008	0.17
306.6838989	0.09
312.1090698	100.00
312.9293213	0.34
321.5342102	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	489.1765
Annotation	Campenoside
Peak:m/z	Relative Intensity
142.7948303	0.10
151.0959473	0.57
159.1994781	0.17
160.8727417	0.82
207.1176300	0.16
209.2816925	0.20
213.2990723	0.09
213.9925232	0.07
214.8910675	0.08
229.3946991	0.06
233.2955933	0.07
254.1815491	0.08
259.2651978	0.15
266.7482910	0.08
279.0541687	0.04
281.2638245	0.04
295.8804321	0.04
299.1873169	0.04
303.1653442	0.05
309.2933960	0.40
313.0461426	0.18
313.7174683	0.05
327.2406616	100.00
331.1691589	0.08
335.1238708	0.09
341.3639526	0.25
341.9929810	0.13
343.3968811	0.05
351.3726807	0.11
355.0314941	0.19
357.4831238	0.07
363.2667236	0.09
366.1243591	0.07
367.3596802	0.09
369.3161011	1.13
373.3125610	0.08
374.5128174	0.33
375.3794556	0.14
377.8563538	0.10
379.9309387	0.05
387.7653809	0.05
393.1913147	0.12
399.0762634	0.38
401.1927795	0.10
403.4059448	0.09
411.1095886	0.07
413.4175415	0.10
415.2206421	0.19
421.3829041	0.09
426.0105896	0.22
429.5617371	0.20
430.5419312	0.16
442.3020935	0.16
443.2226257	0.83
445.1165466	1.33
453.1368713	0.09
453.8856506	0.07
454.5529175	0.07
458.5146179	0.07
459.3288879	1.13
462.2998962	0.12
469.1716614	1.01
471.1564636	9.27
471.8603210	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	495.1175
Annotation	1-Nitro-7-glutathionyl-8-hydroxy-7,8-dihydronaphthalene
Peak:m/z	Relative Intensity
153.2772675	0.03
154.8848419	0.05
167.0899506	0.04
180.9987335	0.03
191.1540833	0.05
194.9383240	0.11
204.9756775	0.02
209.3304749	0.10
241.0290985	4.99
257.4133911	0.04
268.2432861	0.03
272.2519531	0.04
283.1592407	20.52
294.1528320	0.02
300.9434814	0.04
309.2149658	0.23
311.2002258	0.04
323.0393982	0.03
327.1795044	10.63
335.4546509	0.06
338.3002625	0.10
345.2553711	0.05
387.0218811	0.17
388.4396057	0.05
391.2626648	0.06
392.2760925	0.03
401.0278015	0.05
404.6212769	0.11
405.4565735	0.03
409.1813049	63.59
409.7884521	0.43
410.9050598	0.02
413.5216370	0.02
415.3657837	0.06
421.4411621	0.04
431.2969360	0.11
434.4332581	0.06
437.6972046	0.06
440.6164856	0.03
448.2537537	0.22
449.1078186	0.16
451.1813354	100.00
456.3279419	0.74
457.2808533	0.26
458.3428345	0.40
459.2672119	0.19
477.1507263	6.12
477.7605591	0.06
479.3135071	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	397.1262
Annotation	8-C-Methylvelloquercetin 3-methyl ether
Peak:m/z	Relative Intensity
130.0195007	91.69
131.3360748	0.28
186.4121857	0.09
204.0817719	7.61
250.1257019	0.29
257.9557190	0.17
261.9900818	0.25
268.0294495	100.00
271.3115234	0.10
287.1592407	0.51
298.2061157	0.16
315.1589661	0.30
332.7644043	1.53
337.1817017	0.20
351.1408691	0.14
352.9104004	0.15
355.1713562	0.42
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	347.09
Annotation	Mannopine
Peak:m/z	Relative Intensity
108.0723648	0.24
109.1402435	0.06
110.0520172	0.12
117.9683380	0.11
131.1093750	0.04
136.1835022	1.32
136.9851532	1.45
151.2249451	0.05
154.0665894	100.00
173.1182556	1.59
192.0508728	0.07
209.8747253	0.38
213.1272278	0.04
215.2069092	0.04
227.0473938	0.39
254.9309998	0.09
257.2084656	0.13
263.2794495	0.18
303.0305786	0.19
310.8453064	0.14
316.3807068	0.10
329.1688843	0.96
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	409.0443
Annotation	Unknow
Peak:m/z	Relative Intensity
125.0494461	0.07
138.8671265	1.52
151.1553802	0.10
152.0179138	0.08
161.1405029	0.06
164.9794617	0.27
166.9534302	0.75
168.8936462	0.10
181.0828857	0.50
194.9107513	0.04
199.1082306	0.07
199.9334106	0.13
204.7426758	0.14
207.1274414	0.05
208.3090210	0.10
208.9152985	0.06
213.1645966	0.10
223.0310669	1.53
238.3951721	0.04
239.1663208	0.31
241.0335388	100.00
242.0392151	0.20
245.0326538	0.08
246.3074951	0.24
247.1392212	0.19
270.9924622	0.03
276.8874207	0.07
278.1263428	0.10
279.3596802	0.11
281.0681763	0.07
287.3272705	0.16
287.9533997	0.05
289.2895508	0.09
293.2065430	0.03
311.1837158	0.18
312.9393311	0.04
321.0704041	0.07
324.8424072	0.10
328.0344849	0.05
329.2517090	0.51
330.5546265	0.08
340.3565979	0.05
343.0848999	0.13
360.9975281	0.04
363.3538513	0.14
365.2654114	0.31
370.1695251	0.28
370.8891907	0.04
373.0678101	0.06
379.5391235	0.06
386.1852112	0.06
391.1358948	0.56
409.3980713	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	311.2213
Annotation	trans-EKODE-(E)-Ib
Peak:m/z	Relative Intensity
98.98176575	0.93
125.0471039	0.75
129.2087708	0.59
135.2175598	1.50
138.8291321	1.19
141.1505737	0.49
142.9107971	0.69
145.1912842	0.34
147.8789978	0.43
149.2722931	1.25
153.0330811	0.98
155.0677185	0.23
157.0945435	0.81
163.1142273	0.49
164.0682983	0.48
167.0821991	0.98
168.1419373	0.73
171.2832184	1.25
175.1283417	0.70
177.1567383	0.77
181.2532043	0.63
182.1331482	0.42
183.1604309	1.05
189.4286346	0.76
194.9482269	1.07
196.9924622	0.23
198.9502563	1.56
199.557724	0.78
201.0673828	0.23
207.0692444	0.33
209.0728455	2.00
211.1364136	1.19
215.1123962	0.30
219.1573486	0.63
221.1856995	0.96
223.0433044	0.57
225.1619568	2.85
227.2795715	1.02
228.8018494	0.59
233.1647644	0.65
235.3725891	0.65
237.0757751	1.31
238.308136	0.62
239.1539307	1.03
241.143219	1.84
243.1664429	0.65
245.3666382	0.35
251.072937	1.12
253.1094055	4.49
257.1549072	0.48
265.1607361	4.48
266.1000061	1.25
270.1437988	2.47
275.2323303	11.38
282.423584	0.35
283.3363037	1.17
287.7884216	0.38
290.3144836	0.78
293.2166443	100.00
302.2111816	1.36
310.4683838	1.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	447.0531
Annotation	Glucobrassicin
Peak:m/z	Relative Intensity
127.9119110	1.44
130.9165649	0.34
138.9506073	6.52
143.8453064	0.76
145.1170197	2.49
160.0630951	0.69
163.2010956	2.69
169.0916138	2.94
171.9857025	2.83
173.1202393	0.99
174.1227722	0.61
182.9304199	1.35
190.0062866	0.62
195.0519714	5.56
199.0852661	2.58
204.9991150	23.16
221.8923340	0.58
224.0177765	1.65
227.1358185	11.74
241.1769409	4.77
251.1040649	9.57
254.0437622	5.60
255.9575806	5.55
259.0728760	100.00
269.1099243	20.07
273.9367981	1.32
275.0709839	52.27
291.0872803	29.17
367.1340637	11.23
367.9528198	2.03
401.2021790	1.00
413.4971924	1.17
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	525.2343
Annotation	Taxumairol Y
Peak:m/z	Relative Intensity
201.1331635	0.06
231.0086975	0.12
273.2493286	0.08
301.4974365	0.02
303.3737793	0.02
307.0798340	0.02
309.4692383	0.18
315.5396118	0.06
319.4674072	0.28
321.3367920	0.03
327.3541870	0.14
331.2948608	0.07
337.5822754	0.15
339.4982300	0.08
343.8817139	0.11
345.1707153	0.86
353.2700806	0.08
359.3090820	0.04
361.2797852	0.10
363.2481079	100.00
364.2777710	0.42
376.8963623	0.03
379.4011230	0.12
387.0382080	0.05
389.4299927	0.23
399.3051147	0.03
405.2904053	1.99
413.0477905	0.12
417.3309326	0.14
423.0901489	0.10
429.2553101	0.07
435.2033691	0.15
439.1576538	0.03
445.2658081	0.11
447.4104614	0.07
451.2971802	0.04
456.0875854	0.08
456.7515869	0.09
463.3436279	0.31
465.3624878	0.42
465.9810791	0.04
467.4642334	0.05
478.5640259	0.05
479.2962646	0.11
481.4374390	0.43
483.0538940	0.05
488.9786987	0.21
503.3993530	0.34
507.3872070	0.84
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	476.276
Annotation	LysoPE(0:0/18:3(9Z,12Z,15Z))
Peak:m/z	Relative Intensity
159.3803253	0.08
161.1174774	0.04
165.0635529	0.02
179.1016998	0.07
187.1734924	0.01
198.0506287	0.02
205.0988464	0.09
211.3539581	0.04
216.0524902	0.06
223.1171570	0.09
261.3279114	0.08
268.3004456	0.03
299.5297852	0.03
304.4576416	0.17
317.3075867	0.14
335.3700256	100.00
351.1274414	0.06
359.3626099	0.02
360.1179810	0.05
378.4017029	0.22
382.2870789	0.02
408.9912109	0.04
411.0362854	0.02
415.0071106	0.36
427.1830139	0.02
433.2679138	0.12
440.1648560	0.03
441.4864197	0.05
446.8379211	0.09
458.2561951	6.70
459.0238342	0.15
459.7489319	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	542.73
Annotation	gamma-Pentachlorocyclohexene
Peak:m/z	Relative Intensity
194.2094727	0.42
231.8856506	0.71
290.7231445	7.49
292.3083496	0.74
306.8760986	0.14
353.7331543	0.16
365.1428223	0.44
374.5664673	6.58
375.2133179	0.56
378.9130859	0.68
386.8788452	26.39
387.8838501	0.31
390.5620117	1.26
403.8568726	0.44
456.6835327	4.68
457.9092407	36.75
458.6412354	100.00
459.2515259	0.30
460.4881592	0.25
473.8551025	3.60
474.6842651	1.53
495.2361450	0.91
495.8872681	11.81
496.8309937	6.10
500.1590576	1.05
519.4098511	0.16
520.3394165	0.23
521.1052856	1.25
524.2493286	0.25
525.2727051	0.88
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	202.0893
Annotation	Unknow
Peak:m/z	Relative Intensity
61.2369537	0.04
67.9990845	0.04
69.9118957	0.02
72.7922058	0.04
76.0612335	0.29
76.9745560	0.41
78.9539337	1.15
81.0467224	1.00
84.8847122	1.76
86.7942810	0.06
87.9522247	0.36
95.6460419	0.07
97.0848389	0.32
98.0743256	7.12
99.2627716	0.10
102.0895386	0.27
102.7934875	0.04
104.9445801	0.04
107.8866882	0.08
109.9653778	0.24
112.8908844	23.93
115.0179901	0.34
119.7748413	0.13
122.0129852	0.91
129.0956573	0.09
130.0140533	0.60
131.9696960	25.33
134.1550598	0.36
139.1528931	0.58
140.9621277	0.21
142.0067291	0.05
146.1698761	0.13
151.0631256	0.05
156.0602417	9.48
157.0687408	0.35
158.9517365	6.87
159.9208679	0.26
161.0668945	0.22
166.8800812	0.04
174.0499725	0.98
182.6326752	0.06
184.9196472	100.00
186.8750610	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	182.0808
Annotation	4,6,7-Trihydroxy-1,2,3,4-tetrahydroisoquinoline
Peak:m/z	Relative Intensity
122.9958649	0.05
136.0447388	18.73
147.0677338	0.06
164.9325714	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	164.07
Annotation	Homomethionine
Peak:m/z	Relative Intensity
56.0269089	0.21
73.9117889	0.50
83.6916351	0.11
101.9232330	100.00
102.8018799	0.03
110.7361450	0.11
146.0463104	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	472.9247
Annotation	Unknow
Peak:m/z	Relative Intensity
231.7518921	0.06
245.3932953	0.04
267.1092834	0.15
273.0402527	0.18
357.7967224	0.33
359.0307312	0.44
382.9132690	0.04
401.0389404	0.07
426.9967346	100.00
428.1373291	0.16
428.9402771	1.03
445.1404114	0.07
454.9501038	0.07
463.9724731	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	587.1075
Annotation	Unknow
Peak:m/z	Relative Intensity
259.1324158	0.19
259.8888855	0.01
268.4697876	0.07
280.5473633	0.04
300.3640137	0.02
312.4501343	0.04
315.2736816	0.05
327.1129150	0.06
329.1489868	0.02
331.2988892	0.06
338.1082764	0.02
345.2846069	0.03
355.3131714	0.02
358.6582031	0.01
367.3510742	0.01
377.4931641	0.05
378.5273438	0.02
379.1527710	0.10
381.1122437	0.02
382.1965942	0.02
386.0945435	0.03
387.3410034	0.07
389.2533569	0.38
390.4270630	0.08
396.4019165	0.02
397.2228394	0.04
403.1850586	0.03
425.1083984	100.00
426.1630859	17.77
427.0548096	0.10
432.4700928	0.02
434.9931641	0.05
438.9559937	0.02
454.1508789	0.03
455.0787354	0.02
467.0946045	0.09
472.5131836	0.01
477.8926392	0.10
487.8964844	0.01
489.2857056	0.03
489.9077759	0.01
491.2539673	0.15
497.4050903	0.01
499.2324219	0.03
501.2767944	0.05
520.0087280	0.04
526.9627686	0.02
527.6212769	0.03
530.4709473	0.05
541.1801147	0.21
541.9371948	0.08
543.1178589	0.07
544.6198730	0.03
551.0032349	0.24
552.1235352	0.17
557.3699341	0.03
558.3390503	0.02
568.4102173	0.03
569.0381470	0.01
570.4539795	0.14
571.1818848	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	613.13
Annotation	Cefpiramide
Peak:m/z	Relative Intensity
215.7473755	0.07
226.2993164	0.09
231.1423492	0.46
243.1457520	0.13
270.5704956	0.06
285.2819214	0.11
286.5081787	0.16
289.0567627	0.12
342.2098999	0.20
352.1538696	0.10
354.0585938	0.55
355.1256104	0.18
363.2626343	0.06
364.3002319	0.07
365.1811523	0.08
372.2911987	0.31
374.7161255	0.09
389.1531982	0.23
392.1747437	0.06
397.7115479	0.18
406.2719727	0.09
407.7642212	0.30
410.0674438	100.00
419.6838989	0.10
420.8933716	0.47
448.7442627	0.22
452.1824341	0.18
478.1424561	0.06
482.4865112	0.27
483.7213745	0.18
484.3488159	0.32
487.3533936	0.36
491.1541138	0.20
494.0242310	0.16
496.6745605	0.17
501.0152588	0.19
515.4084473	0.18
516.8917236	0.26
525.1422729	0.15
538.2302246	0.10
538.9695435	0.30
546.4722900	0.23
548.6201172	0.19
551.1929321	0.26
566.5009155	0.65
568.7546387	0.64
569.6937866	0.85
574.9003296	0.14
576.9597168	0.79
580.0956421	0.11
580.9508667	0.08
588.1021118	0.49
588.7111206	0.20
594.1732788	0.49
595.0437622	0.50
595.7561646	0.36
598.7735596	0.76
604.1854858	0.60
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	322.0929
Annotation	Indole-3-carboxylic acid beta-D-glucopyranosyl ester
Peak:m/z	Relative Intensity
94.8909912	0.48
101.0755463	0.33
112.9803467	1.90
115.9759979	9.74
118.9288483	0.78
125.1227112	0.11
127.9399109	0.13
130.8807678	0.39
143.0340271	0.97
143.9813080	0.11
155.8586121	0.06
158.1921997	0.03
159.9645996	90.41
161.0081329	0.65
169.9391479	0.11
172.3170471	0.03
174.0630646	0.57
178.9135437	0.55
182.1240692	0.10
202.0186462	28.57
212.1305847	0.15
214.1464844	0.19
232.0917664	10.55
244.1294556	0.15
250.2143250	0.03
256.0941772	0.13
260.1841125	0.11
262.1799622	100.00
274.1756287	0.03
286.0895996	0.08
292.1465454	0.05
303.9924927	0.61
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	591.2627
Annotation	Pheophorbide a
Peak:m/z	Relative Intensity
174.1142120	0.08
193.4992981	0.13
229.1821747	0.08
241.2990570	0.06
246.9125671	0.09
252.2736816	0.06
259.9371338	0.12
267.8020630	0.18
276.9359741	0.14
293.1749878	0.06
295.2137451	0.17
297.6305542	0.04
301.0588989	0.07
309.4054565	0.08
318.9590454	0.04
324.2551270	0.12
334.3196411	0.13
335.5290527	0.33
336.3829956	0.23
337.3041382	0.08
365.4306641	0.07
388.5189209	0.20
391.0888062	0.09
394.3567505	0.09
407.6392822	0.25
420.9882202	0.12
423.4159546	0.06
432.9837036	0.16
437.3757324	0.15
438.2476807	0.04
445.5162354	0.13
447.4287720	0.17
451.3646851	0.11
457.2935181	0.14
462.1983032	0.10
471.1309204	0.15
475.4859009	0.12
477.3527832	0.22
490.3737793	0.12
491.4758301	0.09
506.2782593	0.12
507.6304321	0.22
511.4547729	0.18
515.3483276	96.43
516.1812134	0.05
517.3404541	0.10
518.4909058	0.06
519.0912476	0.12
522.0886841	0.12
523.4943848	0.18
526.4498901	0.19
529.9170532	0.44
531.8898315	0.70
532.6940308	0.22
533.3537598	0.10
534.5649414	0.12
535.6068726	0.15
537.4905396	2.11
540.4010620	0.08
544.2194214	0.12
545.4275513	0.16
546.3056641	0.24
547.4813843	2.44
555.4679565	0.11
557.5316772	0.40
559.2543335	100.00
564.3134155	0.20
565.1795044	0.31
572.0101929	0.43
573.1099243	1.38
573.8118896	0.79
574.4748535	0.04
575.6900024	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	299.2594
Annotation	DL-2-hydroxy stearic acid
Peak:m/z	Relative Intensity
110.9846039	0.19
113.0328827	0.10
129.1595459	0.12
131.1316986	0.10
135.4181366	0.21
137.1461182	0.20
151.2556	0.33
169.0805054	0.32
171.0467224	0.09
171.9251556	0.18
172.7389832	0.16
183.1618958	0.34
184.0640869	0.26
184.8856201	0.37
186.1409454	0.27
193.213913	0.18
197.9694672	0.20
199.2646484	0.18
205.2335205	0.76
209.106842	0.34
211.3094788	0.07
212.8416443	0.18
215.3013306	0.36
218.880249	0.26
224.1918335	0.21
225.2326965	0.90
227.0071106	0.32
234.4208374	0.10
235.4824524	0.11
237.1314697	1.53
239.2823181	0.36
241.1182251	0.18
242.206665	0.14
251.2410889	0.51
253.2538452	100.00
254.3455505	4.43
255.1330566	2.46
255.892334	0.45
256.9538269	0.39
263.224823	1.36
264.1390991	0.14
267.0942993	0.08
268.0986023	0.16
271.2727051	0.29
272.3573914	0.19
279.2406616	0.56
280.49646	1.62
281.3461914	9.75
282.4090881	0.35
283.0715332	2.10
283.925415	0.58
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
135.9656677	16.60
147.2626801	0.08
164.9254608	100.00
165.5254974	0.15
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	567.1224
Annotation	Unknow
Peak:m/z	Relative Intensity
160.7368469	0.10
167.9915619	8.54
177.2261200	0.28
184.0529480	3.65
184.9255981	1.06
190.0459595	0.14
192.0471802	0.33
196.8692474	0.19
198.0999908	0.20
201.9703979	100.00
209.7591248	0.36
214.0807495	0.59
220.9582214	0.11
226.0567169	0.49
243.8392181	1.99
255.8635406	0.19
261.9923401	0.10
273.7966919	0.09
286.1046143	0.61
292.9339600	0.14
295.1497192	0.39
303.2241211	0.31
310.9159546	0.10
317.1838989	0.18
324.2943726	0.06
325.2043457	0.30
329.1379395	1.65
337.2625732	0.12
339.1881104	0.21
345.8125000	2.48
352.2603149	0.07
357.0608521	0.35
359.2518311	0.20
363.0447388	42.23
363.6737061	0.17
365.0907593	0.13
375.0523071	0.49
393.2993164	0.08
405.0416870	0.70
405.9974365	0.67
430.8218994	0.21
449.9529419	0.21
471.1931763	0.14
487.1263428	0.52
489.1581421	0.19
492.2068481	2.39
504.9733276	0.11
507.2263794	0.23
508.2999878	0.66
518.5648804	0.15
521.0501709	4.57
523.2113037	0.41
530.3449097	0.11
533.1714478	5.50
546.2873535	0.09
547.4658813	0.08
548.3698730	0.59
549.0263062	1.04
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
196.9559326	0.87
212.8506622	14.73
233.5421448	0.13
237.5914917	0.09
246.1799927	0.35
274.0442505	0.45
280.7807312	100.00
292.2817993	0.09
296.8522339	49.10
318.2427673	0.21
320.4408569	0.59
336.1248169	0.08
346.2605286	12.05
347.2009888	0.80
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	527.1251
Annotation	3-Hydroxy-L-tyrosyl-AMP
Peak:m/z	Relative Intensity
161.9401398	12.83
183.9887848	0.20
185.1460266	0.10
196.9571991	0.11
213.0665436	0.08
216.2728882	0.28
255.8169403	0.06
292.2579956	0.16
298.0136719	0.09
307.4822998	0.35
310.1712036	0.13
311.2130127	0.26
324.0036621	100.00
330.4127808	0.51
333.5944824	0.34
345.1624756	0.28
364.3511963	4.71
365.4722290	0.75
367.2274780	0.17
379.2228394	0.20
393.0903320	0.30
393.7031860	0.30
394.3209839	0.43
395.1135254	0.54
401.7832642	0.30
425.6232300	0.19
427.0137939	0.13
431.2731323	0.24
446.3238525	0.45
466.1206055	0.06
473.4228516	0.52
481.0756226	0.36
485.5844116	1.83
486.4330444	0.06
490.5829468	0.31
495.1979980	0.44
498.7138062	0.08
501.4475708	0.34
504.9270020	0.25
507.1691284	0.71
508.3125610	1.07
509.2474365	2.56
509.9406128	0.30
515.3090210	0.17
517.6019287	1.43
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	261.0728
Annotation	Ng-L-Glutamyl-L-aspartic acid
Peak:m/z	Relative Intensity
95.7943039	0.06
117.0729370	0.12
127.3349915	0.06
128.0662537	0.53
132.9071960	0.23
145.0307617	2.47
146.0749207	0.31
147.2817230	0.10
170.1684875	0.07
170.9929962	0.07
171.9115295	0.06
177.0492401	0.05
183.0305939	0.03
186.7621002	0.07
189.1227417	0.30
193.2449341	0.06
198.9559326	0.12
201.1952209	0.18
215.0449371	0.25
217.0229950	1.81
218.2179108	0.34
225.0220490	4.13
231.1906128	0.30
233.2761078	0.28
243.0207367	100.00
243.9614410	0.13
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
93.0111389	1.71
136.9472656	100.00
138.0847778	0.02
144.7370300	0.03
158.9609985	0.03
161.0685120	0.27
183.1178284	0.04
227.2630615	0.03
254.8884583	0.07
280.2003174	0.02
281.2490234	0.03
283.9805298	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	557.11
Annotation	Unknow
Peak:m/z	Relative Intensity
196.9779053	0.15
212.9583893	0.70
214.7671204	0.11
231.9433289	1.31
250.9610901	0.85
294.7242126	0.17
298.7034912	0.81
363.9594727	0.61
372.7220459	1.02
373.8438721	0.45
381.6373291	1.09
382.2781982	2.80
387.0966797	0.22
389.0022583	0.37
395.1583862	30.55
397.0172119	0.21
402.0918579	2.33
404.7587280	0.13
419.3338623	0.85
421.0895386	1.78
445.1253662	0.26
452.6781006	0.21
466.9461060	0.24
470.7828369	16.36
472.6248169	100.00
473.9340210	4.59
475.2398071	1.17
479.3912964	0.15
512.1994019	0.15
514.9573364	0.27
534.3541870	0.22
538.7014771	0.43
539.3148804	1.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	265.14
Annotation	(+)-Abscisic Acid
Peak:m/z	Relative Intensity
97.23196411	1.11
109.27034	1.11
123.0823059	9.56
137.1775513	4.03
137.9465332	1.79
144.8846588	2.18
168.9332733	12.32
171.0927582	5.12
173.1496124	2.48
174.9881744	7.88
181.1039886	7.45
189.0914154	2.49
194.2317963	3.17
198.0836639	5.55
201.0856171	1.51
204.9057465	8.42
209.2665863	2.48
211.3257904	5.90
213.6897583	1.66
216.9841156	2.48
219.1220245	11.75
220.0308533	4.36
221.1725616	7.91
222.992691	3.16
223.797348	1.49
225.2990265	1.79
229.1852875	8.88
233.159317	2.35
234.1162872	10.68
235.0100098	4.01
236.1458588	6.15
237.1486206	10.67
243.144577	1.93
247.1349945	100.00
248.0200348	13.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	345.119
Annotation	3,4,5-Trimethoxyphenyl glucoside
Peak:m/z	Relative Intensity
118.9105225	0.12
124.8750610	0.08
137.2648621	0.39
147.3343201	0.13
148.0254517	0.05
154.0666504	0.08
161.1037292	0.39
181.8308563	0.25
212.2928619	0.20
218.2704773	0.30
220.3831787	0.05
247.2000122	0.07
261.0544434	0.12
265.0754395	0.05
269.3421326	0.16
277.1851501	0.18
282.2314758	0.06
283.3276062	0.12
285.1173706	0.35
289.9022827	0.06
299.1879578	100.00
301.0316162	0.49
301.7115173	0.17
306.3025513	0.12
309.2617798	0.09
310.1273499	0.14
311.2891235	0.08
326.2862244	1.22
327.0805054	1.87
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	338.17
Annotation	Unknow
Peak:m/z	Relative Intensity
109.9903488	3.48
133.0783081	0.05
137.9673920	1.11
149.0993347	0.11
156.0661316	8.10
160.8358765	0.06
165.0979004	0.27
175.9398193	0.05
183.1844788	0.11
210.2011719	0.27
210.8351135	0.35
226.0943909	0.08
226.9963989	0.22
232.1692200	0.16
240.4777832	0.40
247.5552979	0.06
256.2247925	0.71
258.2269287	0.12
259.2402649	0.17
260.1595459	0.12
268.2608337	0.06
274.1535339	4.60
275.4484558	0.06
276.0619202	0.09
279.4471436	0.10
282.2661743	0.11
290.3267212	0.11
292.1684570	86.51
293.0159912	0.09
294.0241394	0.14
301.1457214	0.24
302.0410767	0.60
303.4190674	0.28
307.4410706	0.26
313.7145386	0.33
318.3676147	0.15
320.2286682	100.00
321.3260498	1.38
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	554.0912
Annotation	Unknow
Peak:m/z	Relative Intensity
165.1487885	0.15
193.0323639	0.10
194.8448639	0.18
197.3808594	0.04
239.2621460	0.04
247.9663086	0.13
253.2909241	0.06
262.2424927	0.19
281.3490601	0.07
283.1377563	0.11
285.9779663	0.03
304.5051270	0.07
306.0687256	0.15
330.3563843	0.05
338.2097778	0.04
342.3886719	0.07
343.5413208	0.03
346.3037720	0.03
359.4326172	0.03
364.1335449	0.84
367.2279053	0.04
389.3364868	0.07
390.2366943	0.22
391.2592163	0.37
392.3133545	0.25
393.4171753	0.05
398.2463989	0.06
402.3703003	0.05
407.8822632	1.25
408.5646362	0.04
466.4524536	0.08
473.5328979	0.19
476.1259766	0.50
480.5092163	0.03
484.2915039	0.22
492.3618774	0.03
494.7714233	0.02
507.4517212	0.10
508.5957642	0.02
510.0924072	100.00
510.7933960	0.32
533.3162231	0.06
534.2075195	0.11
536.1165161	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	554.0907
Annotation	Unknow
Peak:m/z	Relative Intensity
178.0133209	0.13
185.3418274	0.04
193.0775909	0.18
194.2076416	0.09
195.0584259	0.13
205.0580750	0.04
223.3809509	0.03
226.1183472	0.10
244.0937195	0.05
248.0911713	0.03
276.9180908	0.10
282.6584473	0.12
298.7996216	0.04
305.8864136	0.10
341.2448730	0.18
342.4406738	0.05
343.1435547	0.19
344.2562256	0.14
346.1867065	0.22
347.2965088	0.02
352.2749634	0.05
361.0805054	0.12
364.2114868	0.87
372.2244263	0.11
384.5560303	0.03
385.4514160	0.15
389.2482300	0.75
390.3648071	1.13
391.1788940	3.34
392.2543945	1.07
393.0824585	0.06
395.9275513	0.08
398.2646484	0.08
407.8180542	0.41
413.2948608	0.07
415.4674683	0.04
437.5980225	0.06
455.0917969	0.02
473.3384399	0.11
476.1929932	0.03
483.2400513	0.03
492.2113647	0.23
506.2489624	0.04
510.1010132	100.00
530.5637207	0.23
534.2386475	0.05
535.0468140	0.46
535.7223511	0.09
537.8594360	0.03
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	384.0362
Annotation	Unknow
Peak:m/z	Relative Intensity
128.0202484	2.81
141.2125854	0.10
143.1051636	3.82
145.0104828	0.18
146.0334167	0.46
160.3538208	0.05
169.0679626	0.27
174.9707947	2.26
175.9557495	0.06
177.0319519	0.28
178.9998627	2.76
185.1253357	1.47
189.1537323	0.20
194.2481537	0.10
197.0473938	0.49
203.1644592	0.30
209.3526154	0.12
210.0556946	2.35
211.8431702	0.06
215.1941071	0.09
220.9766541	0.08
224.2017822	0.06
225.9682617	0.43
228.0102539	0.11
229.0780334	0.16
236.0139160	0.07
240.2225342	0.17
252.2763977	0.37
254.1390991	22.66
254.9282227	0.67
267.0689697	0.08
268.2300720	0.31
270.2968140	0.11
272.1751404	100.00
286.1178894	22.35
287.1841736	0.10
289.2241516	0.12
289.9645996	0.12
298.1068726	0.06
304.1108704	89.71
305.1739502	0.16
316.1330566	0.21
318.0890503	0.28
320.0748291	0.17
336.1869507	0.11
337.6984863	1.20
338.3858032	1.30
339.2145996	0.11
340.3483276	0.29
341.1763306	0.19
343.0187073	0.08
345.0110474	0.07
348.1401978	0.17
355.1467590	0.21
356.2681274	0.50
364.2635498	0.09
366.0185852	19.55
366.9746094	0.06
368.2988892	0.22
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	527.144
Annotation	Unknow
Peak:m/z	Relative Intensity
193.1200256	0.01
254.3036041	0.01
265.0710449	0.02
279.0805054	0.01
283.1251221	0.07
284.0702820	0.02
305.8126831	0.01
307.3425293	0.00
313.1972046	0.01
327.2963867	0.04
331.2047119	0.01
333.6437378	0.01
349.1307983	0.03
356.0472412	0.01
361.5170288	0.02
362.2866211	0.01
363.4255981	0.04
364.5092163	0.03
365.3812866	0.14
366.5043335	0.03
381.2895508	0.01
393.2261353	0.00
397.6942139	0.03
399.4802856	0.01
401.0541992	0.01
403.3354492	1.45
404.3553467	0.39
405.6232910	0.01
407.4158936	0.02
423.3683472	0.48
424.4451294	0.03
425.0570679	0.01
427.2650146	0.01
428.7861938	0.01
431.4282837	0.01
437.6978760	0.00
439.5108643	0.01
441.2916870	15.66
442.2806396	3.10
442.9190674	0.01
447.4700317	0.02
451.4079590	0.01
461.0690308	0.01
465.5499268	0.02
467.6701660	0.01
470.3591919	0.00
481.4780884	0.04
483.2332153	100.00
484.2507935	22.72
484.9012451	0.04
489.1910400	0.01
490.3139038	0.04
492.2230225	0.12
493.3964233	0.01
505.7512207	0.01
509.2192993	3.01
510.2282104	0.76
511.6616821	0.01
519.2246704	0.02
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
110.7481232	1.31
126.9151306	1.30
137.1267395	1.37
149.0625916	1.37
151.1319885	2.15
153.2422943	2.30
160.8337402	0.78
166.9812317	1.78
175.0879822	5.66
181.2515259	1.57
193.9532471	1.42
201.1043396	1.90
211.0516357	0.89
221.1142578	0.98
225.1542969	2.27
227.0907898	1.04
228.8982239	1.57
239.3118286	3.00
247.1555176	1.90
248.5997925	1.64
251.2499695	6.91
252.295929	1.74
253.1701965	3.92
265.3153076	5.12
269.9190063	6.35
275.2425842	9.87
279.4664917	1.35
283.1813049	6.86
290.7510986	4.07
293.2150574	100.00
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
100.795578	0.42
109.0375671	1.42
110.8700409	0.53
123.2000122	0.73
125.138092	0.57
126.7160034	0.23
133.1227112	1.55
135.0020905	0.67
137.2097015	0.23
141.1799316	0.25
147.1972656	0.41
149.0879517	0.39
150.9500732	1.07
153.052948	0.55
155.141571	2.31
157.0958252	2.33
161.1287231	0.23
163.1518402	1.11
165.2362976	0.16
167.2081909	0.46
169.0371704	1.48
171.4050903	0.25
174.5312195	1.15
177.1191101	1.75
183.12883	3.54
187.2511139	0.29
188.8802948	0.84
191.4414062	0.54
193.1600952	0.83
195.2559509	1.25
197.1299133	1.88
199.0789795	0.34
204.887146	0.19
206.6559143	0.64
209.023407	0.82
211.0125427	5.17
212.9618225	0.17
214.6513367	1.02
217.1777344	0.41
221.3521729	0.64
222.0856934	0.24
222.8446655	0.35
225.1278992	4.37
226.0186157	0.17
227.1295166	2.24
229.2087708	0.25
233.2712097	0.56
234.9516602	1.26
237.104187	1.70
239.1105347	1.74
240.983551	1.15
244.1680298	0.14
247.1669922	0.70
251.1299744	0.30
251.9441833	0.83
253.3155518	4.71
255.1814575	0.60
257.4101562	0.64
261.2149658	0.21
263.3432312	0.25
265.3186035	2.82
267.2297363	0.99
269.253418	2.42
270.1195679	0.80
275.2301636	18.20
283.055481	2.32
288.1753845	0.58
291.3540039	0.98
293.2163696	100.00
294.378418	1.35
296.8631592	1.02
311.1366272	0.73
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	429.1313
Annotation	Eupachinilide E
Peak:m/z	Relative Intensity
129.0875854	0.11
135.0708008	0.34
137.1811676	0.06
145.9341431	100.00
147.8759460	0.16
162.1296997	0.24
210.8936615	0.09
225.2280426	0.06
229.2971497	0.22
238.1111450	0.16
238.9688110	0.05
243.7801514	0.15
248.5337524	0.08
253.4534607	0.24
256.1513367	0.16
257.4087830	0.60
266.3174744	0.80
267.0130005	3.35
270.4652710	0.04
272.1980286	0.47
276.9576721	0.29
282.0931702	0.13
284.0696411	1.57
295.6172485	0.36
299.7744751	0.17
304.7283936	0.35
306.1445312	0.89
307.8124695	41.59
308.5691528	0.79
309.3608093	0.09
313.2173462	0.22
324.2706909	0.07
328.9731445	0.32
337.3355713	0.18
338.9301453	0.10
345.3237915	0.17
353.8018188	0.24
369.1875305	0.34
369.9996033	0.23
371.3226929	0.14
381.6190796	0.10
382.2443542	0.18
383.2150879	0.30
385.2279358	0.12
388.4370422	0.45
392.5723572	0.10
393.5367737	0.37
400.7861023	0.31
408.2378540	0.06
410.4417419	0.82
411.3158875	2.77
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	441.1432
Annotation	Unknow
Peak:m/z	Relative Intensity
139.1972809	0.07
152.9903870	0.09
192.1048889	0.10
199.1566772	1.06
202.1851044	0.13
218.9866638	0.04
225.3772278	0.21
233.1737976	0.08
237.2985535	0.04
241.0625305	6.81
242.1050415	0.19
256.3459167	0.04
279.0602417	0.17
280.8150024	0.16
295.2959290	0.06
304.2258606	0.10
304.8490601	0.07
308.9355469	0.15
311.4159546	0.19
321.0563965	0.07
333.2921143	0.08
343.1943359	1.99
344.1437378	0.07
345.1998901	0.17
349.2703857	0.06
350.9626160	0.33
353.8563843	0.13
355.0715332	0.52
357.2908325	0.69
359.2777100	0.13
360.1763306	0.11
361.2718811	100.00
362.2870483	9.95
367.9404602	0.07
377.5535583	0.13
394.3452454	0.06
395.2550354	0.59
396.2285461	0.05
397.2670898	2.92
398.2169495	0.54
399.0406189	0.06
402.4321594	0.10
405.0569153	1.18
406.2644043	0.87
410.1082458	0.05
412.2096558	0.12
413.4424438	0.16
416.4005737	0.25
421.0507507	0.09
422.5146179	0.31
423.3268738	0.19
424.2565002	0.13
439.4034729	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	365.1352
Annotation	Tetrahydropentoxyline
Peak:m/z	Relative Intensity
135.0412903	0.06
151.5739288	0.07
153.0237427	0.02
159.1874084	0.06
163.9146729	0.10
166.0184937	0.06
184.2055054	0.06
185.1750336	0.03
189.0102386	0.49
191.0234070	0.09
192.1513824	0.03
193.1291504	0.04
195.3711548	0.02
203.2183380	0.57
205.1486664	0.02
208.0143738	0.03
217.2847290	0.04
222.6409607	0.08
227.3552856	0.04
228.8056335	0.04
231.1684875	0.12
233.3191223	0.11
238.3639832	0.07
245.1541748	0.14
249.2666321	0.09
257.0733643	0.29
258.4368286	0.12
259.4294128	0.05
267.3011475	0.22
268.1177368	0.24
269.1657715	0.21
275.2107544	0.03
277.4279175	0.25
278.3322754	0.03
280.0158081	0.03
285.1299438	0.21
286.3398438	0.08
287.3019409	0.07
288.9800415	0.09
290.9876099	0.16
296.1381836	0.06
302.3004761	0.07
303.8980103	0.07
305.1237793	100.00
307.3821716	0.04
316.8735352	0.05
318.6192627	0.06
319.2913818	0.08
320.2945557	0.13
321.1211243	0.38
323.4108887	0.62
329.1104736	0.18
332.0403748	0.14
334.4752197	0.14
338.1301270	0.02
345.0021667	0.18
346.2679138	0.28
347.2552185	0.64
350.1427307	0.03
365.2723083	0.04
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	281.1394
Annotation	(+)-Cheimonophyllal
Peak:m/z	Relative Intensity
83.0871277	0.08
94.9466248	0.02
105.1213989	0.03
111.1125717	0.42
119.1521683	0.33
120.9703979	0.11
122.9926605	5.94
124.9199677	0.16
131.9931946	0.02
133.0944824	0.28
135.2070770	0.06
136.9109497	0.07
145.0439453	0.91
149.0158386	0.14
151.1080627	0.14
152.9987488	1.64
159.1417542	0.30
161.1115723	0.22
163.2145081	0.02
164.1188049	0.02
165.1624756	0.02
168.9973450	0.31
171.1649475	9.21
175.0730286	0.36
175.9802856	0.04
177.1412048	0.05
178.9025269	0.14
187.3709259	0.05
189.1256409	3.50
191.1238403	0.02
193.0066071	1.81
199.2299805	0.03
200.1901245	0.14
201.1289673	4.28
203.2915344	0.06
205.2797546	0.06
207.1724243	7.16
208.8556519	0.02
219.0885620	10.77
234.9899902	0.06
237.1426392	100.00
241.0191040	0.08
244.8870850	0.10
251.2638550	0.03
253.0272217	0.06
254.0336304	0.02
262.0721436	0.20
263.0874939	1.89
266.8939819	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	355.1034
Annotation	Veranisatin B
Peak:m/z	Relative Intensity
112.9721603	0.31
123.1788025	0.12
131.7973938	0.21
134.0474243	4.49
149.0114136	1.13
158.0290527	0.05
160.0811768	2.34
160.9687195	0.06
173.0037689	0.15
175.0379639	39.88
175.9377289	0.15
177.9940796	0.75
179.1976776	0.09
188.5275269	0.59
191.1061401	1.34
193.0147095	100.00
193.6539612	0.04
202.1092072	0.58
203.0564575	0.90
205.2998352	0.09
207.1236877	0.79
211.0875244	0.06
215.1515808	0.10
217.0665588	70.36
219.2171936	0.07
220.1080627	0.18
220.9890442	0.32
223.1138916	0.46
226.9881897	0.05
230.7839050	0.17
233.0229187	0.53
235.0496826	10.66
239.1321716	0.10
246.9704285	2.32
259.1004333	0.83
259.7284546	0.10
263.4621582	0.04
265.1743774	5.10
267.3066711	0.04
274.8851318	0.08
281.0825500	0.09
285.1148376	0.03
289.2712402	0.10
293.0961914	0.03
295.1492920	6.42
307.1827087	0.08
309.1012573	0.17
310.9187317	0.03
313.1784973	0.17
325.3806763	0.06
334.3872681	0.02
335.4378052	0.11
337.1730347	2.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	779.6482
Annotation	Unknow
Peak:m/z	Relative Intensity
263.2788696	0.07
402.9990234	0.24
403.7392578	0.13
414.0409546	0.69
427.1258545	0.08
431.0186768	0.23
468.3150635	0.11
473.2994995	0.25
496.3355103	0.28
497.3948364	0.08
514.2131348	0.36
530.3416748	0.14
536.5931396	0.19
602.5116577	0.16
653.2503052	0.95
668.5032349	0.22
671.4178467	0.08
682.2499390	0.10
696.1810913	0.95
714.0523071	0.74
718.7921753	0.49
725.4544067	1.31
742.5006104	2.33
744.8806763	0.35
749.3076172	0.60
749.9331665	1.25
750.6939087	1.46
754.1069336	0.65
760.6382446	0.28
762.1863403	0.54
762.9294434	0.55
764.6885986	5.92
765.3296509	4.72
766.3882446	1.17
768.6759033	0.98
769.5335083	0.40
771.0961304	7.08
772.5767212	0.28
800.7814331	0.35
810.7638550	1.93
814.3098755	2.51
846.2753906	0.52
852.4669800	0.44
853.6953125	0.13
854.4840698	0.20
859.0100708	1.05
862.5872192	0.59
864.3153687	0.21
868.7772217	8.32
870.7919312	0.24
871.8188477	0.20
889.4609375	0.22
890.7866821	0.34
896.0219727	0.44
901.3604126	0.34
913.7736816	0.92
938.3731079	2.35
939.1256714	2.17
939.9559937	0.34
946.3679810	0.29
952.1801147	1.01
958.6267090	1.05
960.2839966	0.76
960.8921509	0.56
963.0814819	0.15
966.6299438	9.55
967.3522339	2.09
968.1608887	0.33
969.7046509	0.43
972.5189819	100.00
973.3836060	6.73
974.2500000	0.96
975.1242065	1.58
978.6004028	0.22
979.4515991	0.56
980.2617188	0.40
980.9868164	0.18
987.6522827	0.50
990.4492798	1.46
995.9911499	0.30
1024.1721190	0.21
1052.9152830	0.11
1067.0463870	0.83
1067.7412110	0.32
1068.6394040	0.50
1069.6527100	0.42
1088.4978030	0.40
1089.7020260	0.36
1093.8529050	0.49
1111.4968260	0.49
1124.1718750	0.67
1153.4062500	0.25
1168.0493160	0.07
1186.8640140	0.32
1204.6838380	0.13
1221.6853030	0.53
1279.1490480	0.26
1296.7410890	0.26
1301.8186040	0.63
1304.8289790	0.46
1342.5255130	0.07
1408.0479740	0.23
1408.9732670	0.31
1419.8060300	0.07
1509.8623050	0.55
1531.0112300	0.11
1632.6882320	0.21
1642.6073000	0.07
1758.6314700	0.11
1779.2564700	0.55
1788.0748290	0.50
1807.9512940	0.32
1810.8864750	5.19
1825.1524660	0.09
1858.0499270	3.66
1861.9650880	0.78
1893.4515380	0.09
1900.9752200	0.84
1902.7408450	12.46
1903.4017330	1.83
1909.9832760	0.12
1918.6849370	0.22
1929.8975830	2.97
1933.9470210	0.11
1936.2706300	0.16
1941.7609860	1.76
1951.0891110	0.07
1951.9128420	0.12
1953.5191650	1.44
1955.7902830	0.22
1958.0772710	0.39
1964.6478270	0.23
1965.6057130	4.63
1970.0750730	0.52
1970.8997800	0.61
1972.1358640	0.67
1989.0164790	1.54
1993.1754150	0.25
1994.9504390	0.11
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	278.067
Annotation	N-(E-4-coumaroyl)-aspartate
Peak:m/z	Relative Intensity
87.9720764	2.09
92.9195938	0.73
113.8820038	9.13
115.0092773	6.54
119.0530853	11.29
132.0051270	70.09
139.6762085	0.06
144.9963379	1.31
146.0496216	0.40
146.9535828	0.45
149.1312866	0.35
158.0334473	0.68
160.9125671	0.06
162.1749268	2.88
162.9973297	100.00
163.7612762	0.05
172.7869720	0.07
180.0810547	0.55
188.1423645	3.13
189.1671448	0.10
190.1472473	2.08
190.9635010	0.37
192.3085785	0.05
194.2221680	0.09
197.0593262	0.12
198.2932434	0.17
216.0516052	37.91
217.1148376	1.06
218.0171814	0.41
231.2421875	0.12
232.6054993	0.27
234.1128845	38.08
241.9346008	0.46
259.5300903	1.71
260.1368713	10.16
262.0335999	0.43
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	904.4
Annotation	Unknow
Peak:m/z	Relative Intensity
277.1449585	0.44
328.9797974	0.23
332.1774597	0.45
334.1651917	0.14
398.8314209	0.10
405.5343018	0.10
439.1374512	0.06
444.1372681	0.32
459.4507446	0.14
473.4519043	0.42
474.2303467	0.08
491.2045288	0.13
498.4892578	0.62
531.9840088	0.25
592.9574585	0.14
600.4459839	0.20
601.6377563	0.31
611.7888794	1.01
622.2412720	0.33
630.1380615	0.16
656.3117676	0.20
677.3567505	0.10
688.4270630	0.40
703.4531860	0.08
707.0250244	0.24
720.7008057	0.19
721.3402710	0.13
724.1475830	0.06
729.8168335	0.11
764.9473267	0.06
780.5190430	0.15
804.9244995	0.23
808.2604370	0.10
819.7597046	0.39
830.1820679	0.14
832.9783936	0.26
842.9890747	1.23
849.3295898	0.23
856.9037476	1.39
864.4752197	0.64
866.9772339	0.81
867.7819214	0.22
868.6047363	0.38
871.5479126	0.70
873.5172729	0.73
874.4810791	0.26
876.7440186	1.04
877.3998413	1.15
880.8646851	2.15
882.5989990	0.62
883.2840576	2.80
884.1260376	0.32
885.7052002	1.13
886.6337280	0.46
890.5661011	0.17
892.0049438	2.93
894.2509155	0.40
925.7811890	0.13
936.3450317	0.75
943.0314941	0.10
947.0043335	0.08
953.6125488	0.55
954.9813843	0.21
955.9067383	0.33
962.7418823	0.28
967.6777954	2.32
969.7420044	0.55
970.4507446	0.20
972.1782837	1.48
972.9963989	0.38
974.7262573	0.15
979.2096558	0.31
982.3960571	0.75
984.4645996	0.12
986.3132324	1.42
988.1597290	0.32
991.7062378	0.30
992.7412720	0.76
994.1881714	0.12
996.6857300	0.64
999.1813965	0.93
999.9287720	0.15
1000.6945190	1.42
1001.5264280	0.15
1002.1995240	0.41
1003.0718380	2.20
1003.9982300	0.61
1005.4646610	1.32
1006.4636840	2.12
1007.4812010	0.56
1008.4492190	3.02
1009.9970700	1.80
1011.2588500	10.49
1012.4425660	2.41
1013.4311520	1.98
1014.4387210	2.69
1015.9545900	41.80
1017.1384280	1.31
1018.8849490	1.52
1019.8366700	0.46
1020.5725710	0.45
1021.7353520	2.37
1022.9613650	5.67
1024.5645750	5.28
1025.9377440	5.94
1027.4541020	38.58
1028.5357670	1.43
1030.4423830	100.00
1031.6374510	3.97
1032.5583500	2.88
1033.4094240	9.27
1034.2514650	3.44
1034.8747560	0.18
1036.3266600	0.60
1037.3867190	0.40
1038.5263670	1.50
1040.3564450	0.39
1045.9511720	0.16
1050.8874510	0.48
1053.3266600	0.25
1054.1291500	0.27
1059.7104490	0.51
1062.0146480	0.29
1062.8797610	1.06
1064.6676030	0.12
1066.6921390	0.76
1070.3004150	0.21
1082.5679930	0.56
1083.7634280	0.81
1093.5710450	0.66
1101.2711180	0.94
1103.8386230	0.13
1108.6533200	1.60
1111.4676510	0.20
1112.7443850	1.02
1114.9268800	0.08
1117.8259280	2.41
1118.6999510	0.31
1120.6977540	0.06
1123.4830320	0.35
1131.4802250	0.23
1132.1619870	1.12
1140.5146480	0.23
1141.8181150	0.23
1142.6975100	0.45
1144.6357420	0.38
1149.9824220	0.38
1152.0490720	0.80
1153.3867190	0.40
1154.9609380	1.29
1155.6787110	0.49
1156.3066410	0.23
1159.6983640	0.12
1161.3057860	1.39
1163.4599610	0.18
1166.3057860	1.23
1167.4797360	0.22
1170.0776370	2.01
1173.0900880	1.25
1174.6339110	1.39
1177.8400880	0.08
1179.3940430	0.10
1180.8486330	1.06
1181.6517330	1.18
1183.5137940	1.25
1186.0389400	0.57
1187.2567140	3.37
1187.8696290	1.18
1189.0848390	5.26
1189.7331540	2.64
1191.9647220	1.76
1192.7333980	3.92
1193.4685060	1.95
1194.4235840	1.15
1195.3306880	0.14
1196.2244870	5.85
1196.9709470	0.14
1198.5124510	2.73
1199.3583980	2.02
1200.2885740	0.18
1201.1097410	0.21
1202.5283200	0.30
1203.2227780	0.85
1204.7155760	3.61
1205.7829590	0.44
1206.6163330	4.51
1207.4581300	1.05
1209.7172850	2.14
1210.4368900	1.65
1213.3718260	7.26
1214.0446780	2.61
1215.2092290	1.15
1216.5820310	1.30
1217.7769780	0.15
1220.1614990	0.34
1223.4254150	0.87
1224.6918950	0.09
1235.8077390	0.46
1237.6162110	1.54
1243.0092770	0.69
1244.7718510	0.17
1251.0085450	0.08
1272.6019290	0.14
1280.8587650	0.95
1317.0258790	0.13
1329.2575680	0.51
1352.8316650	0.54
1356.1951900	1.15
1358.0391850	0.28
1363.8170170	0.68
1374.6296390	0.60
1387.4572750	0.66
1398.9254150	0.21
1402.8123780	0.68
1405.1478270	0.15
1419.1394040	0.13
1419.9095460	1.02
1436.6265870	0.79
1443.2916260	0.07
1444.0479740	0.55
1449.5318600	0.69
1454.1079100	1.36
1455.6063230	0.44
1457.6459960	0.25
1458.5379640	0.51
1459.2360840	0.99
1461.2612300	0.67
1466.8277590	0.45
1468.7584230	0.56
1471.7645260	1.66
1475.9140620	0.49
1484.6805420	0.66
1490.8811040	1.48
1504.0568850	0.20
1507.8835450	0.53
1514.6507570	0.17
1534.4510500	0.29
1563.6175540	1.02
1571.9124760	0.38
1588.9808350	0.27
1590.7237550	0.22
1594.0817870	0.28
1607.2257080	0.36
1612.4044190	0.10
1623.2801510	0.44
1639.0861820	0.36
1647.8962400	0.12
1653.6702880	0.14
1657.6208500	0.73
1665.6490480	0.59
1677.0280760	0.13
1686.1276860	0.30
1695.6331790	0.55
1699.4415280	0.62
1714.6253660	1.06
1720.4132080	0.35
1731.7899170	0.58
1733.1370850	0.64
1734.4703370	0.69
1743.8546140	0.07
1791.1823730	0.09
1800.8680420	0.34
1802.6843260	0.30
1808.4317630	0.10
1812.3210450	0.56
1818.5860600	0.65
1821.5461430	0.55
1823.3381350	0.31
1826.1475830	0.12
1839.0057370	0.24
1848.0155030	0.31
1851.7259520	0.29
1861.8424070	0.23
1872.4625240	1.21
1878.1202390	1.89
1883.6444090	0.19
1885.7344970	0.22
1887.8088380	0.28
1891.9591060	0.50
1898.0621340	0.10
1911.3983150	0.23
1918.5372310	0.49
1925.3018800	0.32
1933.9847410	0.06
1943.8109130	8.43
1950.9177250	0.14
1952.1182860	0.96
1955.8409420	19.78
1958.8127440	3.10
1968.3602290	0.82
1976.4586180	0.52
1977.9782710	0.08
1982.8192140	0.24
1989.3568120	4.18
1992.5256350	0.08
1999.3073730	0.52
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
174.6385345	0.20
175.9832611	0.75
206.8752289	7.20
212.9483795	0.23
254.8703613	0.44
279.0281677	0.09
282.2584839	0.13
290.7881775	100.00
296.7781982	1.69
314.9923706	0.21
330.1965637	0.12
337.1481934	0.17
338.6257935	4.51
348.0546265	0.58
352.8704224	0.74
368.7460632	1.33
374.0460815	3.79
374.8682556	45.17
389.7600403	0.33
394.4728088	0.22
398.7994690	20.06
412.8454590	3.74
428.3431091	0.90
440.9761353	0.27
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	399.1443
Annotation	S-Adenosylmethionine
Peak:m/z	Relative Intensity
125.3700714	0.12
126.8840179	0.08
136.0503693	2.46
163.0677185	0.95
183.9906921	0.04
227.7514954	0.12
236.9392090	0.32
250.1795959	100.00
251.8654480	0.14
255.9699707	0.29
264.0615540	4.66
266.9545898	0.31
285.1138000	0.07
298.1535645	54.99
301.2515869	0.13
339.2789917	0.10
353.1112976	0.15
363.9130859	0.11
367.6846313	0.10
380.2819214	0.14
381.3253784	0.45
389.4430237	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	309.21
Annotation	9(S)-HpOTrE
Peak:m/z	Relative Intensity
96.74650574	0.17
109.0218735	0.49
114.8073578	0.17
125.0080872	0.10
128.8097229	0.11
137.0739899	0.23
138.9885254	0.26
143.1764526	0.10
150.0557861	0.16
153.1456146	0.75
156.7903595	0.07
162.7478333	0.24
165.2304077	1.20
166.6753845	0.08
173.0213623	0.09
179.0831909	0.57
180.249176	0.21
181.0897064	0.30
193.0907593	1.91
195.1311646	0.08
197.260025	0.25
199.0295563	0.19
208.1966858	0.21
209.1264343	1.67
210.1897278	0.44
211.146759	0.47
215.4599304	0.24
219.1184998	0.34
221.0508423	0.61
221.9450989	0.16
229.2478943	0.28
235.2578735	0.43
237.1191101	0.53
237.996582	0.30
238.9745178	0.20
240.1962891	0.21
241.0833435	0.54
244.8455811	0.18
247.2922363	3.43
249.3411255	0.67
251.0852356	0.81
252.1639404	0.13
253.2937012	0.22
255.2412109	0.35
258.9711914	0.23
265.3631592	3.15
267.1723938	1.28
271.0485535	0.09
273.1777954	6.20
273.9945984	0.13
281.2818298	0.66
289.3430481	0.31
291.20047	100.00
292.3535156	0.11
293.2738953	0.20
303.4932861	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	611.1445
Annotation	Oxidized glutathione
Peak:m/z	Relative Intensity
176.9208527	0.13
179.0507965	3.20
180.0352325	0.49
185.0199432	0.20
192.1018677	0.40
197.1264343	0.24
201.0432739	0.06
203.7078247	0.11
208.8953094	0.06
209.9954529	2.56
210.9827576	0.18
211.5933838	0.05
226.2637634	0.18
226.9149628	0.14
228.1817627	0.51
230.1239319	0.12
236.1383972	0.31
242.1044159	0.23
252.2362671	0.40
253.0809631	0.07
254.1331329	11.20
255.2367859	1.22
262.9519958	0.05
272.1292114	36.02
273.2037964	4.69
286.0488892	0.53
286.7864990	0.11
288.1878052	5.81
289.0791626	0.64
304.1265564	14.15
306.1228638	100.00
307.1683044	9.41
309.9234009	0.09
320.0397339	0.61
321.0883789	0.03
338.0591431	44.61
339.1040039	5.02
353.1641846	0.04
361.2937012	0.07
362.3650513	0.13
363.1734619	0.15
399.7665405	0.07
450.1373291	0.10
464.1181030	1.04
465.1505737	0.19
482.1624756	33.59
483.2385254	5.70
510.5534058	0.16
528.0804443	0.06
536.1262817	0.07
575.2302856	0.55
575.8914185	0.03
576.5010376	0.07
577.3272095	0.04
593.1963501	18.95
594.1849365	5.11
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
199.0666199	0.02
201.0346985	0.06
217.1576538	0.02
228.9204712	0.15
230.2099609	0.09
236.1130219	0.11
272.9779968	5.36
274.0217285	2.96
275.1088867	4.47
276.1339111	0.50
364.3886719	0.04
386.9810791	7.46
388.0415649	6.49
388.9926147	14.08
389.9685669	3.08
427.0134888	0.01
469.9788208	0.01
470.8570557	0.05
487.1852417	0.05
500.9613037	20.52
502.1221924	29.40
502.9636841	100.00
503.9148560	32.23
526.8764038	0.04
527.8948364	0.03
529.3841553	0.01
533.4085083	0.02
542.5704956	0.04
545.3450317	0.02
555.9625244	0.03
559.8001709	0.02
560.6611938	0.03
570.9364624	0.22
571.8989868	0.03
572.7968750	0.04
574.0799561	0.04
581.4735107	0.03
588.6611938	0.06
590.1742554	0.01
598.9724731	0.02
599.6401978	0.02
602.0696411	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	421.16
Annotation	Ugonin P
Peak:m/z	Relative Intensity
127.2257538	0.17
128.7860107	0.09
130.1511383	0.05
144.0438995	0.08
146.0446472	0.39
146.9357605	0.06
153.8485413	0.23
163.0246429	0.05
180.0841370	0.14
199.0369415	0.09
203.9401855	0.06
210.0726013	0.35
215.0434570	0.81
216.3295746	0.11
217.2808075	0.56
224.2672577	0.06
226.2201538	0.15
227.1045227	0.39
229.1716766	0.28
231.2947998	0.07
241.1413574	0.25
244.1749268	0.26
255.1667786	0.06
259.0493164	4.77
272.1731262	0.18
275.1563721	1.34
277.1213684	100.00
301.1559753	0.52
315.6310425	0.18
319.1887512	2.19
322.9571228	0.17
333.9396057	0.78
339.1905518	0.04
342.1805725	0.60
343.0469971	0.31
359.2475891	0.74
360.1721497	0.45
361.2398987	0.15
374.9870911	1.09
377.4412537	0.51
378.2680054	2.72
379.2615356	1.38
379.9477844	0.06
385.6043091	0.18
390.1546021	0.13
402.1200867	0.17
403.3586121	0.30
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	449.1212
Annotation	Artonin P
Peak:m/z	Relative Intensity
129.7810974	0.16
138.0416870	0.17
139.8912659	0.15
146.8692017	0.24
148.1095886	0.09
154.0042114	0.14
155.0247803	0.11
164.9377441	0.56
168.0254517	0.23
173.2168884	0.08
182.0450439	3.16
183.0991516	0.28
184.1809692	0.18
185.2937927	0.12
186.0039978	4.59
197.0350342	0.16
202.1933441	0.06
204.0059204	19.02
209.0432129	0.32
211.1431885	0.06
216.9749451	0.10
228.1861877	0.08
229.0289917	0.35
245.4943237	0.14
246.1807251	1.82
249.9594727	0.93
267.9581909	100.00
269.2332153	0.39
284.0075378	0.18
286.2207947	0.23
287.2487793	0.21
289.2566528	0.14
300.1817017	0.19
310.5745239	0.07
316.3647766	0.63
320.3659058	0.11
328.3981628	0.05
329.3031006	0.65
330.1537476	0.26
333.1521606	0.30
335.1657715	0.26
343.0747681	0.69
344.1794434	0.13
350.4997559	0.24
352.9880371	0.31
353.7777405	0.18
358.1704102	0.17
359.4178772	0.09
360.1865845	0.09
373.1221619	0.32
374.4127502	0.08
384.9881897	0.38
387.1221619	0.12
405.1987000	0.09
412.4450989	0.37
430.2391357	0.52
431.2519836	0.84
432.5087585	0.29
439.3153381	0.48
441.4466248	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	495.0448
Annotation	Unknow
Peak:m/z	Relative Intensity
152.9927521	0.05
160.9601288	0.03
161.9847870	0.05
167.2823029	0.04
177.1001434	0.04
179.0051422	0.05
183.6889343	0.03
188.9507141	0.02
197.1585083	0.05
201.9712524	0.02
211.6733398	0.02
241.0957336	0.03
245.1802979	0.03
254.0302429	0.33
257.2256165	0.09
272.1270447	0.46
273.2544556	0.09
283.1891174	0.49
288.2169495	0.35
289.1190186	0.09
291.0751038	0.10
297.9770508	0.02
306.0919495	16.29
307.1152039	2.20
308.1379395	0.11
315.3122559	0.06
327.2531738	0.17
332.0634155	0.02
336.2814331	0.04
338.0820923	0.23
338.7820129	0.03
349.1663818	0.10
359.1489563	0.02
370.1319580	0.04
371.0272217	0.13
375.4718933	0.02
389.1825256	0.04
391.0630798	0.22
395.2466125	0.02
398.1679382	0.08
401.2166443	0.05
405.1397400	0.10
409.1088562	63.64
410.2316284	0.04
411.3716125	0.04
412.7126770	0.06
415.2266541	0.23
419.2313843	1.94
420.5758057	0.02
427.2357178	0.03
429.3285522	0.05
431.2256470	0.02
434.1919250	0.06
434.9788208	0.04
436.1595154	0.04
440.5237732	0.06
441.4117432	0.05
446.5549622	0.05
447.4504700	0.15
449.1780701	0.15
451.1017761	100.00
458.2508545	0.20
459.0963745	0.08
463.1623230	1.14
464.2966003	0.04
467.0713196	0.03
475.1503601	0.12
477.1391296	5.29
477.8801575	0.07
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	541.14
Annotation	Resveratrol 4'-(6-galloylglucoside)
Peak:m/z	Relative Intensity
161.1125641	0.31
161.9919586	0.24
179.1817932	1.86
180.0034027	0.14
198.0632019	0.07
198.9459839	0.18
218.3970337	0.06
221.1451569	0.24
262.4882202	0.07
268.7251587	0.08
280.8104858	0.18
282.3018799	0.07
283.1808472	0.14
306.1738281	0.28
311.1918945	0.19
317.1580200	0.14
322.9927368	0.45
324.4461060	0.07
325.0808716	0.12
340.0747070	0.12
341.0838623	3.34
342.1021729	1.12
354.8558350	0.08
361.2833862	0.17
377.1964722	4.26
378.1973877	9.64
379.1261597	15.05
384.1018066	0.14
401.0159912	0.06
405.7937012	0.12
443.0139160	0.14
444.1706543	0.82
445.0256348	0.46
503.2156372	100.00
504.2365112	87.22
505.2160034	18.93
505.9261475	0.08
510.3895264	0.14
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	716.62
Annotation	Unknow
Peak:m/z	Relative Intensity
290.7890015	0.31
293.0005493	0.56
316.0625000	0.24
380.8229370	0.32
390.8047485	0.15
418.1784668	0.34
418.7813110	0.24
460.7983398	0.74
463.2476807	0.32
464.7056885	1.33
488.7436523	0.26
502.1528931	0.81
502.8132935	1.40
504.8676147	0.23
540.8060303	0.39
541.9523315	0.12
544.6746216	0.53
546.4714966	2.35
547.8701782	2.27
548.7577515	5.48
561.0726929	0.45
562.9013062	0.21
564.5169678	0.17
579.1699219	0.72
580.0216064	0.85
580.8380127	0.34
586.0010376	0.52
586.6130371	6.29
618.3484497	0.16
630.0365601	0.78
631.2881470	1.36
632.4539185	50.04
633.1773071	0.32
647.9413452	0.24
651.8070068	0.05
670.5088501	100.00
693.0366821	1.72
693.7068481	0.77
698.3585815	0.58
699.1253052	0.77
701.8447876	0.15
707.2024536	0.40
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	475.0734
Annotation	Unknow
Peak:m/z	Relative Intensity
156.4854584	0.10
212.9658203	0.14
227.3085480	0.13
245.1934204	0.05
248.1720276	0.07
265.0111084	0.13
281.9597778	0.60
283.0054016	0.59
292.1874390	0.08
299.4892883	0.05
306.8636475	0.18
342.3889160	0.04
344.8484192	0.24
350.1406250	0.07
351.1007385	2.05
380.0844421	0.19
420.9468079	0.09
425.3061829	0.13
436.8882141	0.09
439.1635742	100.00
457.0671082	8.28
458.1391602	0.23
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	587.1075
Annotation	Unknow
Peak:m/z	Relative Intensity
194.8906097	0.02
209.1809387	0.10
227.2777557	0.03
235.2666626	0.03
250.1457520	0.04
259.0975647	0.31
259.8807983	0.03
274.9885254	0.02
283.2695923	0.02
298.3569336	0.02
302.2708435	0.01
305.4881592	0.03
306.2747192	0.02
307.4144897	0.01
322.9148560	0.02
323.7984619	0.02
326.0381470	0.04
327.3904419	0.01
328.3773193	0.02
345.2183838	0.12
346.3244019	0.01
350.0297241	0.02
359.1334839	0.04
362.0844116	0.02
370.2670288	0.05
384.2272949	0.01
389.1674805	0.53
389.9554443	0.04
390.5786743	0.03
405.6887207	0.01
410.1868896	0.03
411.2570190	0.04
412.5426025	0.04
415.8908081	0.05
423.2943726	0.03
425.1076660	100.00
426.2188721	18.11
427.5286865	0.03
435.4081421	0.06
444.1483765	0.03
451.7269287	0.03
455.6451416	0.01
457.7316895	0.01
458.5682983	0.09
459.2489624	0.07
466.6796875	0.02
467.2921143	0.03
468.3190308	0.01
472.6347046	0.04
477.1798096	0.05
488.4262085	0.07
489.2014160	0.01
490.1126709	0.02
491.0994263	0.06
494.4446411	0.05
495.8876343	0.01
500.4384155	0.03
501.3161011	0.04
502.5379639	0.06
507.3830566	0.11
509.0872192	0.04
513.3297119	0.02
526.3805542	0.07
527.1343384	0.13
529.3220215	0.02
537.4036865	0.01
539.5653687	0.03
541.1085205	0.05
542.0283203	0.04
543.1893311	0.29
544.4295044	0.08
549.4651489	0.05
550.8671875	0.61
551.4722290	0.25
552.1415405	0.18
556.1251221	0.05
557.7644653	0.08
559.0206299	0.06
561.0441284	0.01
567.3862915	0.08
569.4331665	0.11
570.4636230	0.10
572.3897095	0.02
573.3916626	0.05
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	454.2917
Annotation	PE(16:0/0:0)
Peak:m/z	Relative Intensity
167.2369080	0.03
173.0863800	0.05
175.3155823	0.06
187.1136780	0.04
189.1590729	0.06
198.0885010	0.09
205.2250061	0.09
216.1895447	0.12
233.0441284	0.15
282.4474182	1.15
300.6384583	0.11
311.5906982	0.18
313.2971802	39.27
315.0427246	0.04
316.2469788	0.03
352.9095154	0.17
353.9866028	0.13
380.3076782	0.05
390.4068298	0.11
393.1260681	2.83
393.7623901	0.03
394.5250549	0.06
396.1211548	0.16
401.0376282	0.37
405.3581848	0.09
411.2725525	0.13
418.3867493	0.11
419.1184387	0.05
423.1845398	0.24
436.2011719	100.00
437.5905151	0.31
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	603.0031
Annotation	UDP-D-galactose(2-)
Peak:m/z	Relative Intensity
182.0271301	0.15
192.8920288	0.44
200.8970337	0.08
211.0424805	4.00
214.9814453	1.61
216.9181824	0.05
219.7628326	0.05
232.9421844	0.19
236.4177246	0.19
238.8262329	0.15
240.9694366	4.16
243.9783936	0.12
254.1412354	0.21
257.0508423	0.89
259.0911255	0.66
260.0483704	0.39
262.0705872	0.42
265.0498657	0.13
266.3219299	0.10
273.9468994	0.09
280.0505371	2.26
293.1117554	0.37
298.9515381	0.45
304.9547729	0.23
308.1710205	0.07
310.8724060	0.36
317.1793213	0.06
318.1904907	0.07
320.9386597	0.31
323.0622559	100.00
329.0445557	7.21
334.1920776	0.97
347.1053467	0.08
348.5850830	0.15
350.9399414	0.21
352.0214844	0.29
354.0063477	0.09
354.6617432	0.18
356.1102905	0.05
359.0412598	6.44
361.1108398	0.38
370.8579102	0.74
372.0395508	0.12
377.0794067	8.90
380.0688477	1.44
382.2564697	0.46
384.3247681	0.15
385.0817261	0.17
386.8403320	0.16
389.7903442	0.42
391.1208496	0.15
396.3872681	0.22
397.9731445	1.17
401.1111450	0.13
401.8255615	0.11
406.2460938	0.81
410.2028198	0.13
414.1233521	0.07
416.0918579	0.15
419.1105347	4.51
423.0638428	2.98
424.2078857	1.47
426.1530762	0.86
428.9331055	17.41
431.0404053	0.14
435.2527466	0.12
441.0296631	42.32
444.0086670	0.30
444.7880249	0.05
446.7587280	6.18
447.7080078	1.01
449.1083374	0.97
450.1869507	0.12
452.1434326	0.68
453.0712280	0.23
458.0632935	0.49
462.1368408	0.48
464.4584351	0.21
466.7609253	58.86
467.7341309	1.27
470.0906372	10.84
470.9102173	0.72
473.2330933	0.20
483.0942993	27.04
484.8027344	0.54
486.1771240	0.33
488.1212158	3.01
490.0465698	0.08
491.0947266	3.13
500.1832886	1.24
504.8909302	0.63
505.8751221	0.20
514.1066895	0.09
516.2601318	0.14
517.0981445	0.43
518.8012085	24.48
524.0426636	1.56
524.6780396	0.08
534.8421631	0.18
536.8980713	0.06
542.1173706	1.67
554.9885864	0.09
556.9862061	0.24
560.0562744	66.46
584.0155640	0.36
585.1521606	22.63
585.8042603	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
166.2172089	0.48
184.0729828	13.68
285.2504883	0.18
297.0108643	0.29
307.3969727	0.09
349.6390381	0.09
355.2058105	0.15
435.3323975	0.11
443.4628296	0.10
467.8345947	0.18
502.3943481	100.00
503.0846558	0.14
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
59.98827362	0.15
109.0652161	0.19
123.109375	0.03
126.9534607	0.23
131.7637787	0.09
134.7922821	0.10
158.9241638	0.39
160.1588287	0.11
163.0257416	0.05
163.9722443	0.06
168.8782501	0.05
176.889267	0.11
188.0713959	100.00
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	477.0638
Annotation	4-Methoxyglucobrassicin
Peak:m/z	Relative Intensity
158.7966003	1.03
162.9943237	0.43
174.1623230	1.02
176.8795624	0.79
194.8957825	3.74
198.9505310	1.53
201.2685852	2.52
201.9139099	2.02
227.0621796	10.86
235.0628052	19.99
240.9838562	10.43
252.1259460	0.85
252.9253845	2.58
254.0931702	0.59
259.0217590	100.00
275.0418701	79.82
281.1880493	8.04
284.0120544	2.37
285.8049622	0.63
291.1181641	54.01
299.1020508	11.79
328.2304382	0.41
397.0946655	5.28
441.3044739	0.58
457.1861877	2.00
458.2235413	1.40
459.3426819	1.88
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	435.1343
Annotation	E-3174
Peak:m/z	Relative Intensity
128.1722717	0.03
143.1561584	0.04
160.2112122	0.07
160.8966980	0.03
164.9063110	0.03
177.0633545	0.22
179.0092773	0.05
196.9367981	0.02
197.7138672	0.01
205.1146851	0.01
235.1088257	0.03
251.2650757	0.04
252.9838867	0.03
254.1768494	0.68
255.2894897	0.12
260.1041870	0.03
272.2424011	1.24
273.1293640	0.40
277.1811829	0.02
279.0860596	0.05
288.1312256	1.80
289.0517578	0.53
299.2136230	0.01
301.1604919	0.03
306.1331482	100.00
307.1913452	14.88
326.3019104	0.02
329.2102966	0.02
340.2049561	0.01
348.3061829	0.01
349.3854370	0.02
351.0148315	0.01
353.8406372	0.02
357.0296021	0.02
358.0209351	0.02
371.1874390	0.01
375.1365662	0.21
387.4967957	0.05
388.5038452	0.03
389.3103943	0.05
390.2477722	0.07
392.0241394	0.04
393.3782654	0.02
394.2868958	0.02
397.9736328	0.03
400.1286926	0.13
415.6570740	0.02
417.2789001	0.28
418.0211487	0.07
419.1414490	0.01
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	308.0901
Annotation	Glutathione
Peak:m/z	Relative Intensity
113.5875549	0.08
116.7896118	0.38
118.0508728	2.48
129.1783142	0.05
129.9061584	0.06
132.8379974	0.23
143.8585205	1.19
145.1310272	0.60
145.9624023	1.73
148.0481262	2.16
150.9687500	0.06
162.0339661	6.58
162.9419098	6.81
163.9931641	23.32
173.7324219	0.07
178.9854889	35.54
179.9817047	32.87
181.0647888	100.00
216.1268921	0.23
217.2740173	0.20
229.0448914	0.14
233.1059265	4.82
234.0659790	9.74
235.0447083	20.91
245.3822021	1.04
246.2979431	0.97
247.1762390	1.21
263.1905518	0.20
268.3734741	0.23
272.0140381	0.16
273.2571106	1.64
274.1956177	1.15
275.4070435	0.09
277.9501343	0.20
278.7424011	0.16
290.1131897	0.48
291.1093140	4.98
292.1550903	12.95
293.0981140	1.40
300.8535156	1.89
301.7554626	0.51
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
100.9657135	0.92
107.1763	0.34
109.0236969	0.24
119.2215042	0.64
123.1952744	1.22
135.0762634	0.47
136.9431763	2.66
138.709671	0.32
140.9240723	0.66
146.1097107	0.70
147.0991211	0.51
148.9918671	1.01
157.0553436	2.68
159.160675	0.82
161.0901489	1.19
166.9551086	2.43
168.6184082	0.80
170.8709412	0.85
175.0055389	0.89
177.2294922	0.93
179.1700745	0.27
182.0251923	0.44
183.3276367	1.87
185.1422577	0.33
187.1877594	1.38
188.9438171	0.54
197.0114441	1.14
199.1655731	2.26
201.0788269	0.57
207.3853455	0.58
208.9827271	1.59
211.0428772	3.33
213.334259	0.67
215.1785889	0.44
219.4207458	0.49
220.7481384	0.39
223.2940979	0.39
226.7886658	0.59
231.3953552	0.24
235.2399902	0.49
237.1946411	0.61
238.9683838	2.03
240.8548279	0.37
245.0140381	0.56
246.8945618	1.19
249.3387451	2.61
251.3211365	4.93
252.1308289	1.08
253.0640869	3.73
254.2689209	0.29
265.1520691	3.73
266.1920776	0.43
267.1311646	0.89
269.0306396	1.36
270.0450134	1.10
272.1950073	0.94
275.2149353	16.73
281.2217407	0.29
283.3693542	4.36
284.0167236	0.32
288.1726074	1.79
293.2174377	100.00
294.2923584	0.65
296.2483826	0.34
307.1962585	0.81
311.3334961	2.20
312.3101807	0.85
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	457.0963
Annotation	Bikoeniquinone A
Peak:m/z	Relative Intensity
128.9479675	0.41
141.0810242	0.29
144.9456940	0.11
148.9612122	0.04
159.0819550	0.76
165.2746124	0.03
167.1200256	0.19
172.0384827	0.04
175.1033630	0.20
176.9902344	0.04
178.8086548	0.06
179.5213013	0.02
183.8038330	0.04
185.1010132	0.02
190.1360474	0.01
207.2476807	0.08
209.0142822	100.00
209.6167450	0.26
225.9546356	0.07
231.7208862	0.02
249.0495605	0.02
254.0984497	0.29
260.0039062	0.04
263.9137878	0.05
270.0549622	0.07
272.1812439	1.14
286.1750793	0.12
288.0178833	0.08
289.2612305	0.02
295.1119385	0.03
304.1244507	3.50
306.1330261	0.55
308.8382568	0.13
311.0571289	0.03
314.0191040	0.02
328.1766968	0.17
332.3101807	0.05
336.2148438	0.03
338.0821533	0.73
341.1786499	0.03
348.0486450	0.06
348.8531189	0.03
359.0586548	0.40
363.9512329	0.12
365.3228455	0.03
366.2358398	0.11
367.2050171	0.14
369.0603943	0.02
370.0835571	0.19
379.0514221	0.03
394.1100159	0.11
395.2599792	0.02
407.2370911	0.42
413.1726379	0.03
415.2574768	0.03
439.0672913	0.57
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
155.0249329	0.04
158.9402466	2.55
160.0665588	0.36
199.0657043	0.48
200.0402222	0.10
217.0398254	0.24
217.8334656	0.01
229.0252533	0.72
230.1202698	0.04
272.9814453	52.13
274.0101318	11.98
385.1990051	0.06
386.9466858	100.00
387.9197998	36.81
426.9913025	0.06
427.9262390	0.05
439.0350037	0.05
446.0364990	0.01
457.1089478	0.02
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	476.2761
Annotation	LysoPE(0:0/18:3(9Z,12Z,15Z))
Peak:m/z	Relative Intensity
147.0107117	0.12
149.1688995	0.11
153.0591125	0.04
155.1404419	0.13
159.2799683	0.12
163.2671356	0.19
171.1166840	0.06
173.2439270	0.29
175.3256226	0.07
177.2018127	0.11
179.0672760	0.12
180.1436615	0.27
187.2455750	0.27
198.1098938	0.07
205.5842438	0.09
211.4674377	0.22
215.3700562	0.05
218.9172668	0.03
221.3343048	0.06
229.3216248	0.11
236.8643799	0.11
243.2065735	1.35
247.1137848	0.08
253.1423035	0.14
261.2362366	2.30
275.2828979	0.08
277.4335327	0.09
279.1900330	0.08
293.2455444	0.21
299.1474609	0.26
304.4093323	2.24
306.8717346	0.14
311.3034973	0.04
317.2753906	0.40
319.3883667	0.12
321.1138306	0.08
322.3815308	0.30
331.3441467	0.13
332.9835815	0.19
335.2997437	51.87
341.2657166	0.36
345.6331482	0.44
353.2286987	0.18
356.3355103	0.03
359.2301025	0.26
378.5962219	0.32
393.3229675	0.05
394.7438660	0.11
398.9608459	0.07
400.2504272	0.08
403.4127502	0.05
408.3151550	0.06
412.3390503	0.08
415.2301025	9.08
415.9005737	0.11
420.4382935	0.10
427.2689514	0.07
431.0018616	0.22
432.6104126	0.18
433.2578735	0.61
440.3164673	0.04
441.3513184	0.11
458.1737976	100.00
459.1156616	0.95
466.9843140	0.16
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	320.1487
Annotation	(2S)-(-)-7,8-Dimethoxyplatydesmine
Peak:m/z	Relative Intensity
120.0093689	0.28
121.6254196	0.08
137.2653503	0.05
141.0227661	0.18
148.0689697	0.08
161.2314453	0.06
166.0077057	1.03
179.1098022	0.07
180.2473755	0.18
185.2230835	0.12
190.0437775	0.15
195.0622711	0.15
196.0438232	0.23
196.9744568	0.13
205.2697449	0.14
209.1289673	0.10
210.3559265	0.15
231.1907654	0.06
242.8224792	0.07
244.1227112	0.13
244.7366333	0.40
253.3424988	0.12
255.2109680	0.22
256.2172241	0.52
256.8624878	0.12
264.2333679	0.27
271.5070801	0.06
274.1035461	44.41
276.0216980	0.13
278.8656006	0.35
283.9818726	0.15
285.2224121	0.55
289.0230103	0.26
302.0733643	100.00
303.1682739	0.78
305.0596313	0.09
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	positive
CollisionEnergy	NA
PrecursorMz	348.27
Annotation	Broussonetine M
Peak:m/z	Relative Intensity
111.8855438	0.17
113.0274963	0.30
116.0318756	0.05
117.7967834	0.08
120.9224854	0.47
122.9352341	0.26
126.8289413	0.05
127.8040771	0.17
130.8710785	0.23
135.4098206	0.29
136.1175232	0.30
139.1846008	0.09
140.0714111	0.05
141.1332092	0.08
142.1388855	0.08
143.1162720	0.23
145.1640015	0.15
147.1483002	0.08
157.0464172	0.87
158.1114502	0.52
158.9847412	0.23
160.0036926	0.11
161.1422272	0.60
164.1629333	0.10
164.9427185	0.10
169.1784058	0.06
171.1307068	0.40
173.0631256	0.24
174.0873413	0.81
175.1385956	0.77
177.1809692	0.07
180.9865723	0.16
182.2838898	0.07
184.9481964	0.67
187.0912476	0.54
188.0346680	0.25
189.3523865	0.17
192.1916199	0.10
198.7011108	0.14
201.1283112	3.71
202.1039734	0.14
203.0989838	0.53
205.0641174	0.20
207.1252136	0.10
208.6811981	0.22
213.0580444	0.10
213.9848022	0.14
217.1424561	1.83
223.2810974	0.10
224.0784607	0.27
226.9942322	0.22
229.0606995	0.48
231.2546997	0.09
232.2898865	0.37
233.1315002	0.19
239.0763245	0.18
241.1455383	1.12
247.4477234	0.11
248.3874207	0.21
253.1419373	0.45
256.1475220	0.20
259.0815430	1.57
263.3831787	0.09
264.9387817	0.69
267.2478638	0.15
269.0406494	0.52
269.9052124	0.14
272.5249023	0.89
273.1900635	5.74
276.1473694	2.84
277.4721375	0.27
280.4372559	0.05
281.0836182	0.07
282.3951416	0.15
284.2699585	0.14
285.2451172	0.16
286.4781494	0.22
288.1695557	0.75
289.3128052	0.11
294.2793884	6.33
299.2860718	0.15
302.1386108	0.37
302.8898926	0.13
306.1284485	0.17
312.2870178	23.29
313.2228699	0.23
317.1769714	16.21
318.1341553	0.50
320.3121948	0.18
328.7655640	0.58
330.2973328	100.00
331.2109985	4.78
339.1238098	0.10
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	385.1138
Annotation	3'-O-beta-Glucopyranosyl plumbagic acid
Peak:m/z	Relative Intensity
112.9636078	0.03
125.0916901	0.05
130.9556427	0.02
135.2354431	0.02
143.0700836	0.05
146.9678802	0.08
148.9366455	1.00
153.0631409	0.60
161.1431274	0.21
164.0656433	4.39
174.9256897	0.24
179.0679932	1.29
189.9608002	5.03
203.1670380	0.04
204.9925385	53.85
205.9148102	0.40
208.1054840	0.57
211.0952301	0.05
218.1707916	0.16
221.1024017	1.53
223.0578003	100.00
223.9210510	0.07
232.0630493	1.08
233.1531372	0.53
237.1741333	0.89
245.3040771	0.04
247.0499268	55.44
249.1175537	0.17
251.1552429	0.35
263.1994324	0.36
265.0763550	9.87
267.2402039	0.02
277.1192017	2.37
287.2346191	0.02
289.1687622	1.11
293.2767334	0.07
295.1104126	4.59
305.3205872	0.15
307.1231079	0.04
318.9177246	0.06
323.3602295	0.08
325.1920776	5.10
337.7489014	0.04
356.8072205	0.05
365.1410828	0.02
367.1665344	1.52
370.0086060	0.06
END
BEGIN
MsLevel	MS2
Instrument	LTQ-FT (Thermo Fisher Scientific)
InstrumentType	LC-FTICR-MS
IonMode	negtive
CollisionEnergy	NA
PrecursorMz	442.0657
Annotation	Unknow
Peak:m/z	Relative Intensity
140.0354767	1.19
150.0990906	0.63
153.0489807	0.66
157.8796539	0.06
165.9634705	0.22
168.8140869	0.55
171.0048218	2.46
174.9844055	15.85
176.3466797	0.06
183.3092957	0.31
184.0526733	0.99
198.0666809	0.44
199.9779968	0.23
202.0598297	4.96
214.1322021	2.88
227.0289001	0.07
230.1249084	0.40
248.0046387	10.81
251.1573792	0.32
252.1660461	0.19
256.0436707	0.07
259.1611633	0.07
266.0306702	100.00
267.1197205	0.21
272.2861938	0.22
274.1192017	0.20
276.8306885	0.06
288.3107910	3.58
289.0957336	0.07
297.1073914	0.19
301.1318359	0.08
304.1043701	0.32
306.1734619	2.55
310.2414551	0.10
313.2751465	0.12
315.0625000	0.16
325.3054199	0.10
326.4804077	0.10
328.9475708	0.12
331.1051941	1.37
332.2184448	0.73
333.0319824	0.13
334.2934265	0.04
334.9454956	0.12
338.2040710	0.30
343.4605713	0.29
344.0801392	1.26
350.1101379	0.37
354.9898682	0.20
368.1409607	1.32
375.3238831	0.13
376.3196411	0.14
377.2337341	0.29
378.1722412	0.11
380.2110291	0.17
381.9911194	0.11
383.2624512	0.06
398.4748840	0.07
424.3208618	2.47
END