AtMetExpress Development LC-MS

Perk Nr:adn031149. 3-methylsulfinyl-n-propylglucosinolate

Polarity: [NEGATIVE]
Retention time: 1.28
m/z: 422
Annotation: 3-methylsulfinyl-n-propylglucosinolate
Annotation level: Identified
compound:
MS2Ts 50 MS2Ts
KNApSAcK C11H22N1O10S3(46):3-Methylsulfinylpropyl glucosinolate;Glucoiberin;
C14H18N1O10S2(44):C14H19NO11S2-H2O;
in-house MS/MS Gluconasturtiin_CE40(37)
sinigrin _Ramp5-45 V(35)
Purified dimer glucosinolates(34)
Gluconasturtiin_CE50(33)
4-methylthiobutyl glucosinolate_Ramp5-45 V(24)
Represetative peak This peak

eFP visualizaion


Raw chromatograms


MS2Ts

ATH06n03122

ATH06n03532

ATH06n03915

ATH07n03456

ATH07n04007

ATH07n04012

ATH08n05953

ATH08n06401

ATH08n06784

ATH08n06787

ATH09n06033

ATH09n06672

ATH10n03648

ATH10n04315

ATH11n02820

ATH11n03085

ATH11n03630

ATH12n02593

ATH12n02852

ATH12n03014

ATH12n03019

ATH14n05666

ATH56n06801

ATH56n07067

ATH56n07806

ATH56n08058

ATH57n06826

ATH57n08057

ATH58n06894

ATH58n07158

ATH58n07921

ATH58n07924

ATH59n06748

ATH59n06752

ATH59n07491

ATH60n06676

ATH60n06680

ATH60n07407

ATH61n06022

ATH61n06025

ATH61n06957

ATH61n07192

ATH62n06310

ATH62n06313

ATH62n07497

ATH62n07500

ATH63n06139

ATH63n07144

ATH64n06435

ATH64n07130

Peak intensity data

Sample 1 2 3 4 Average
ATGE_1 1.2562 0.9143 1.4462 1.4461 1.2657
ATGE_7 2.9598 2.4384 3.0308 3.6255 3.0136
ATGE_9 2.7957 1.7133 3.1779 2.1577 2.4612
ATGE_10 2.7957 3.4285 2.3156 1.1199 2.4149
ATGE_12 0.8021 0.281 0.5913 0.3154 0.4975
ATGE_13 0.5395 0.4989 1.1666 4.1623 1.5918
ATGE_14 3.3269 2.3306 1.7604 1.6832 2.2753
ATGE_15 5.9112 4.0227 3.6557 4.6955 4.5713
ATGE_16 5.211 5.8886 6.9537 5.4595 5.8782
ATGE_19 3.3015 3.9041 4.2035 3.8126 3.8054
ATGE_20 3.9479 3.6336 4.7403 3.8151 4.0342
ATGE_21 3.6472 4.8314 2.5369 3.3039 3.5798
ATGE_25 0.0394 0.101 0.1218 0.0979 0.09
ATGE_26 2.4097 2.2074 1.6204 1.5282 1.9414
ATGE_27 1.8223 1.6791 0.7287 1.468 1.4246
ATGE_28 1.7698 2.8405 1.6129 2.2216 2.1112
ATGE_29 5.9137 5.6957 6.1513 5.9802 5.9352
ATGE_32 7.3758 6.265 6.2796 5.7397 6.415
ATGE_33 7.0476 9.7604 7.3326 7.0392 7.7949
ATGE_39 6.9974 6.457 8.6734 4.4603 6.647
ATGE_41 1.6108 1.173 1.9065 1.9065 1.6492
ATGE_42 4.5464 3.346 2.6774 3.919 3.6222
ATGE_45 5.7721 5.3049 3.6256 4.7361 4.8597
ATGE_76 5.488 2.2686 4.9938 4.6962 4.3617
ATGE_77 5.2079 5.0367 6.3133 5.8753 5.6083
ATGE_78 4.1186 0.0446 3.941 4.5168 3.1553
ATGE_84 0.0388 0.0652 0.0757 0.0676 0.0618
ATGE_91 3.6728 2.5216 3.5995 3.637 3.3577
ATGE_92 6.6716 7.2279 7.3063 6.6397 6.9614
ATGE_93 0.0435 0.0587 0.0076 0.0163 0.0315
ATGE_95 0.0208 0.0204 0.0411 0.0168 0.0248
ATGE_96 0.1433 0.0183 0.0111 0.3984 0.1428
ATGE_97 1.0418 1.9132 2.3784 1.5409 1.7186
ATGE_98 0.2355 2.7586 0.1842 0.1518 0.8325
ATGE_99 0.0275 0.2956 0.0428 0.033 0.0997
ATGE_101 4.2407 4.0694 4.6214 4.6385 4.3925
RIKEN Plant Science Center
Metabolome analysis research team, LC-MS Branch