AtMetExpress Development LC-MS

Perk Nr:adp003770. indol-3-ylmethylglucosinolate[fragement]

Polarity: [POSITIVE]
Retention time: 3.41
m/z: 207
Annotation: indol-3-ylmethylglucosinolate[fragement]
Annotation level: Identified
compound:
MS2Ts 38 MS2Ts
KNApSAcK C11H11O4(33):Lathodoratin, Scoparone, 6-Hydroxymethylherniarin,
C6H11N2O6(33):C6H10N2O5+O; C5H8N2O5+CH3O;
C10H11N2O1S1(32):3-Indolylmethylthiohydroximate; C10H10N2OS;
C8H15O4S1(25):C8H14O3S+O; C8H14O5S-O; C7H12O3S+CH3O;
C8H15O2S2(18):(R)-Lipoic acid;R-(+)-Thioctic acid; C8H14O2S2;
C5H11N4O5(14):C4H8N4O4+CH3O;
C7H11O7(13):C7H10O6+O; C6H8O6+CH3O;
C10H11N2O3(5):C10H10N2O2+O; C10H12N2O4-H2O;
in-house MS/MS L-beta-homoproline-HCl_CE10(8)
DL-Pipecolinic acid_CE10(8)
1-Amino-1-cyclopentanecarboxylic acid_Ramp5-45 V(8)
3-Indoleacetic acid_CE30(8)
1,1-Dimethylbiguanide hydrochloride_CE10(8)
3-Indoleacetic acid_CE20(5)
N-Acetyl-DL-glutamic acid_CE20(5)
1-Amino-1-cyclopentanecarboxylic acid_CE10(5)
Represetative peak This peak

eFP visualizaion


Raw chromatograms


MS2Ts

ATH06p01886

ATH06p02675

ATH06p02919

ATH07p01885

ATH07p02408

ATH08p01882

ATH08p02417

ATH09p01901

ATH09p02424

ATH10p01618

ATH10p02389

ATH11p02160

ATH11p02697

ATH12p01876

ATH12p02395

ATH13p01626

ATH13p01629

ATH13p02945

ATH13p02949

ATH56p02202

ATH56p03009

ATH57p01667

ATH58p02199

ATH58p02202

ATH58p02476

ATH58p02737

ATH59p01665

ATH59p03008

ATH61p03262

ATH61p03795

ATH61p04074

ATH62p02477

ATH63p01663

ATH63p01926

ATH63p02466

ATH63p02470

ATH63p02473

ATH64p02998

Peak intensity data

Sample 1 2 3 4 Average
ATGE_1 0.4925 0.4956 0.4879 0.5619 0.5095
ATGE_7 0.5299 0.5312 0.5064 0.7101 0.5694
ATGE_9 0.2546 0.2805 0.1186 0.2196 0.2183
ATGE_10 0.4321 0.5832 0.4988 0.3875 0.4754
ATGE_12 0.3353 0.3818 0.3634 0.3241 0.3512
ATGE_13 0.2569 0.3318 0.2817 0.52 0.3476
ATGE_14 0.2742 0.3128 0.2651 0.2223 0.2686
ATGE_15 0.4561 0.3894 0.3186 0.351 0.3788
ATGE_16 0.4995 0.4574 0.4242 0.4307 0.4529
ATGE_19 0.185 0.1079 0.2139 0.2014 0.1771
ATGE_20 0.3535 0.4522 0.3514 0.4619 0.4047
ATGE_21 0.3872 0.519 0.4274 0.4293 0.4407
ATGE_25 0.0402 0.0714 0.0785 0.0416 0.0579
ATGE_26 0.3821 0.4957 0.3146 0.3131 0.3764
ATGE_27 0.1593 0.1327 0.1321 0.0801 0.126
ATGE_28 0.1424 0.1219 0.1743 0.0802 0.1297
ATGE_29 0.859 0.7802 0.8976 0.9657 0.8756
ATGE_32 0.67 0.6552 0.7569 0.8284 0.7276
ATGE_33 0.6146 0.6069 0.6068 0.5123 0.5851
ATGE_39 0.5485 0.5127 0.5378 0.1493 0.4371
ATGE_41 0.053 0.0971 0.0741 0.0741 0.0746
ATGE_42 0.1502 0.1086 0.0916 0.083 0.1084
ATGE_45 0.3733 0.3917 0.3292 0.3327 0.3567
ATGE_76 0.5108 0.1154 0.4799 0.4916 0.3994
ATGE_77 0.4952 0.425 0.506 0.4884 0.4787
ATGE_78 0.4882 0.239 0.1929 0.7885 0.4272
ATGE_84 0.1683 0.1376 0.1614 0.1691 0.1591
ATGE_91 0.3291 0.2214 0.3144 0.2901 0.2888
ATGE_92 0.6766 0.664 0.7127 0.6295 0.6707
ATGE_93 0.1525 0.1607 0.1195 0.1438 0.1441
ATGE_95 0.1165 0.1294 0.152 0.0971 0.1237
ATGE_96 0.1477 0.103 0.1258 0.1955 0.143
ATGE_97 0.1918 0.2061 0.2728 0.2562 0.2317
ATGE_98 0.2053 0.4263 0.2127 0.148 0.2481
ATGE_99 0.1866 0.1679 0.1846 0.141 0.17
ATGE_101 0.3333 0.3454 0.3119 0.3476 0.3345
RIKEN Plant Science Center
Metabolome analysis research team, LC-MS Branch