AtMetExpress Development LC-MS

Perk Nr:adp012562. 8-methylsulfinyl-n-octylglucosinolate[fragement]

Polarity: [POSITIVE]
Retention time: 3.36
m/z: 414
Annotation: 8-methylsulfinyl-n-octylglucosinolate[fragement]
Annotation level: Characterized
compound:
MS2Ts 38 MS2Ts
KNApSAcK C21H24N3O6(33):C20H21N3O5+CH3O; C21H25N3O7-H2O;
C16H24N5O8(32):C10H13N5O3+C6H10O5;
C22H24N1O7(23):alpha-Narcotine, Synerazol; C22H23NO7; C22H23NO6+O
C17H24N3O9(12):SB 219383; C17H23N3O9;
in-house MS/MS
Represetative peak This peak

eFP visualizaion


Raw chromatograms


MS2Ts

ATH06p05807

ATH06p06364

ATH07p05620

ATH07p06057

ATH08p05890

ATH08p06742

ATH09p05810

ATH09p06247

ATH11p05855

ATH11p06402

ATH11p06683

ATH12p05624

ATH12p06119

ATH13p06767

ATH13p06770

ATH13p07409

ATH14p06480

ATH14p07006

ATH56p05761

ATH56p06362

ATH57p05446

ATH57p05875

ATH58p06595

ATH58p06870

ATH58p07618

ATH59p05655

ATH59p06108

ATH61p07390

ATH61p07915

ATH62p05454

ATH62p05868

ATH63p06750

ATH63p07217

ATH63p07220

ATH63p08010

ATH63p08273

ATH64p07128

ATH64p07884

Peak intensity data

Sample 1 2 3 4 Average
ATGE_1 0.1292 0.1686 0.1239 0.2032 0.1562
ATGE_7 0.5154 0.5557 0.5751 1.0028 0.6623
ATGE_9 0.517 0.4522 0.1958 0.286 0.3627
ATGE_10 0.2754 0.4389 0.3965 0.2923 0.3508
ATGE_12 0.0886 0.1124 0.0843 0.0422 0.0819
ATGE_13 0.187 0.1668 0.127 1.3884 0.4673
ATGE_14 0.9286 0.4568 0.4025 0.3774 0.5413
ATGE_15 3.6294 1.7213 1.0493 1.9372 2.0843
ATGE_16 6.5797 2.6482 2.7454 4.4649 4.1096
ATGE_19 0.7739 0.5776 1.0106 1.2419 0.901
ATGE_20 1.4619 1.6819 2.0213 1.9655 1.7827
ATGE_21 0.7668 1.1414 1.3252 1.0057 1.0598
ATGE_25 0.0014 0.0018 0.0039 0.0015 0.0022
ATGE_26 0.5019 0.965 0.385 0.1905 0.5106
ATGE_27 0.0441 0.1133 0.0245 0.0287 0.0527
ATGE_28 0.011 0.1247 0.0094 0.0267 0.0429
ATGE_29 3.1135 5.3906 3.558 3.4115 3.8684
ATGE_32 7.6763 8.9658 7.3101 7.3397 7.823
ATGE_33 3.5263 7.31 6.7657 6.5241 6.0315
ATGE_39 3.1718 5.0275 3.0623 2.0689 3.3326
ATGE_41 0.2234 0.6153 0.4498 0.4498 0.4346
ATGE_42 1.602 0.9887 0.8868 1.0439 1.1304
ATGE_45 2.2927 3.2688 2.2088 2.2845 2.5137
ATGE_76 1.3683 0.213 1.2075 1.1621 0.9877
ATGE_77 1.7657 1.0421 1.1905 1.4 1.3496
ATGE_78 2.2564 0.0033 0.2108 0.5914 0.7655
ATGE_84 1.6742 1.7762 2.0371 1.9377 1.8563
ATGE_91 0.2788 0.3256 0.4198 0.28 0.3261
ATGE_92 2.6109 3.1033 2.9357 5.9257 3.6439
ATGE_93 0.1965 0.2593 0.1661 0.1314 0.1883
ATGE_95 0.1796 0.2051 0.2009 0.1158 0.1754
ATGE_96 0.2625 0.2184 0.2293 0.2146 0.2312
ATGE_97 0.0526 0.079 0.0831 0.0907 0.0763
ATGE_98 0.3213 1.5667 0.3404 0.2868 0.6288
ATGE_99 0.5447 0.3398 0.2514 0.3237 0.3649
ATGE_101 0.6939 0.3888 0.4252 0.51 0.5045
RIKEN Plant Science Center
Metabolome analysis research team, LC-MS Branch