ピーク情報

トマト Micro-Tom 花

pos

Peak #5881 MN MID: SE203_S31_M90

m/z: 677.35711, RT: 42.89, 強度: 2791270, ログ強度: 2.79, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 1

DB検索結果: (2 names) 3beta-(beta-D-xylopyranosyloxy)-6beta,8beta,15alpha-trihydroxy-campest-22E-en-28-yl sulfate;(25S)-3beta-(beta-D-xylopyranosyloxy)-6beta,8,15alpha-trihydroxy-5alpha-campest-22E-en-26-yl sulfate

DBごとのヒット数: ALL 2 LM 2

FlavonoidSearch最大スコア MS2: -, MS3: -

組成式	分子量	誤差(Δppm）	候補化合物名（代表で最短名を記載）	化合物ID
C33H56O12S	676.34925	0.865	3beta-(beta-D-xylopyranosyloxy)-6beta,8beta,15alpha-trihydroxy-campest-22E-en-28-yl sulfate	LipidMAPS: LMST05050011
C33H56O12S	676.34925	0.865	(25S)-3beta-(beta-D-xylopyranosyloxy)-6beta,8,15alpha-trihydroxy-5alpha-campest-22E-en-26-yl sulfate	LipidMAPS: LMST05050012

MSnスペクトル情報

Level: 2, プリカーサーm/z: 677.35437

Splash: splash10-007o-0090260000-789082053260e84615f0

m/z	Int.	NL	Rel.Int.
293.27	768880	384	1000
531.40	482249	146	627
222.12	345719	455	449
513.40	238138	164	309
439.34	158735	238	206
532.41	143578	145	186
456.37	116694	221	151
294.33	107962	383	140
221.21	94039	456	122
514.46	89207	163	116
660.55	58868	17	76
223.10	42758	454	55
457.48	41593	220	54
659.58	39163	18	50

Level: 3, プリカーサーm/z: 293.21619

Splash: splash10-00di-0090000000-c22be0a64aac1f2925c7

m/z	Int.	NL	Rel.Int.
222.18	631125	71	1000

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Aurone]-A(1OMe, 1([2,3:@@]-Furano))-B(none)	Aurone	4-Methoxyfurano[2'',3'':6,7]aurone
[2-(alpha-oxobenzyl)benzofuran (3-OMe)]-A(1([2,3:@@]-Furano))-B(none)	2-(alpha-oxobenzyl)benzofuran	Derriobtusone A
[alpha-substituted Chalcone (alpha-Methyl)]-A(1OMe, 1Methyl, 1([2,3:@@]-Furano))-B(none)	alpha-substituted Chalcone	Purpuritenin B
[Chalcone]-A(1OMe, 1([2,3:@@]-Furano))-B(1Methyl)	Chalcone	Purpuritenin A
[Flavone]-A(1([2,3:@@]-Furano))-B(1OMe)	Flavone	2-(2-Methoxyphenyl)-4H-furo[2,3-h]-1-benzopyran-4-one
[Flavone]-A(1([2,3:@@]-Furano))-B(1OMe)	Flavone	Pongone
[Flavone]-A(1([2,3:@@]-Furano))-B(1OMe)	Flavone	Cauliflorin A
[Flavone]-A(1([2,3:@@]-Furano))-B(1OMe)	Flavone	Glabone
[Flavone]-A(1([2,3:@@]-Furano))-B(1OMe)	Flavone	2-(4-Methoxyphenyl)-4H-furo[2,3-h]-1-benzopyran-4-one
[Flavone]-A(1OMe, 1([2,3:@@]-Furano))-B(none)	Flavone	Kanjone
[Flavone]-A(1OMe, 1([2,3:@@]-Furano))-B(none)	Flavone	9-Methoxy-7-phenyl-5H-furo[3,2-g][1]benzopyran-5-one
[Flavone]-A(1OMe, 1([2,3:@@]-Furano))-B(none)	Flavone	Pinnatin
[Flavonol (3-OMe)]-A(1([2,3:@@]-Furano))-B(none)	Flavonol	Karanjin
[Flavonol (3-OMe)]-A(1([2,3:@@]-Furano))-B(none)	Flavonol	Ponganone XI

Level: 3, プリカーサーm/z: 531.36743

Splash: splash10-0006-0090000000-e7728e3d57ea64eb7c2c

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

FlavonoidSearch結果

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Dihydrochalcone]-A(3OH, 2(6-Isopropyl-3-methyl-2-cyclohexenyl))-B(none)	Dihydrochalcone	Neolinderatin
[Flavanone]-A(1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(3OH, 1(2,4-dihydroxyphenyl))	Flavanone	Eriosemaone C
[Flavone]-A(1OH, 1OMe, 1(1(O-<2-Methylbutyroyl>)-C-Glu))-B(1OH)	Flavone	Isoswertisin 2''-O-(2'''-methylbutyrate)
[Flavone]-A(1OH, 1OMe, 1(1(O-<2-Methylbutyroyl>)-C-Glu))-B(1OH)	Flavone	Isoswertisin 3''-O-(2'''-methylbutyrate)