ピーク情報

ポプラ, 幼植物, 地上部

pos

Peak #1061 MN MID: SE205_S08_M90

m/z: 443.22331, RT: 21.91, 強度: 43740, ログ強度: 1.04, 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) Benzenepropanoic acid, beta-((2-carboxyethyl)thio)-2-(8-phenyloctyl)-, (betaS)-;3-(2-Carboxyethylthio)-3-(2-(8-phenyloctyl)phenyl)propanoic acid

DBごとのヒット数: ALL 2 HM 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
C26H34O4S	442.21778	-3.942	Benzenepropanoic acid, beta-((2-carboxyethyl)thio)-2-(8-phenyloctyl)-, (betaS)-	HMDB: HMDB0259585
C26H34O4S	442.21778	-3.942	3-(2-Carboxyethylthio)-3-(2-(8-phenyloctyl)phenyl)propanoic acid	HMDB: HMDB0258325

MSnスペクトル情報

Level: 2, プリカーサーm/z: 443.22348

Splash: splash10-0002-0900000000-3c7e2545f2e0443f9c9a

m/z	Int.	NL	Rel.Int.
147.93	686	295	1000
129.86	105	313	152
426.17	84	17	122

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Isoflavone]-A(2OH, 1OMe, 1(C-Prenyl))-B(3OMe)	Isoflavone	6-Prenylisocaviunin
[Flavan 3-ol]-A(2OH)-B(2OH)-C(1(O-Galloyl))	Flavan 3-ol	Catechin 3-O-gallate
[Flavan 3-ol]-A(1OH)-B(3OH)-C(1(O-Galloyl))	Flavan 3-ol	Robinetinidol 3-O-gallate
[Flavanone]-A(2OH, 1(5-methyl-2-(2-hydroxyisopropyl)-4-hexenyl))-B(2OH)	Flavanone	Exiguaflavanone M
[Flavanone]-A(2OH, 1(C-Prenyl), 1(2,3-Dihydroxy-3-methylbutyl))-B(1OH)	Flavanone	Lonchocarpol B
[Flavanone]-A(2OH)-B(2OH, 1(7-hydroxy-3,7-dimethyl-2-octenyl))	Flavanone	Propolin A
[Flavanone]-A(2OH)-B(2OH, 1(7-hydroxy-3,7-dimethyl-2-octenyl))	Flavanone	Propolin B
[Flavanone]-A(2OH, 1(7-hydroxy-3,7-dimethyl-2-octenyl))-B(2OH)	Flavanone	Prokinawan
[6,12a-Hydroxyrotenone]-A(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(2OMe)	6,12a-Hydroxyrotenone	Villol

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果