ピーク情報

リーフレタスグリーン

pos

Peak #7065 MN MID: SE198_S12_M90

m/z: 379.10049, RT: 44.88, 強度: 22049, ログ強度: 0.85, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 2

DB検索結果: (2 names) 2,2-Dichloro-12-(4-chlorophenyl)dodecanoic acid;Vaccihein A

DBごとのヒット数: ALL 2 KN 1 HM 1

FlavonoidSearch最大スコア MS2: -, MS3: -

安定同位体ラベル実験で見積もられた原子数:

N: 0

S: 0

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
C18H25O2Cl3	378.09201	3.166	2,2-Dichloro-12-(4-chlorophenyl)dodecanoic acid	HMDB: HMDB0249301
C18H18O9	378.09508	-4.948	Vaccihein A	KNApSAcK: C00033464

MSnスペクトル情報

Level: 2, プリカーサーm/z: 379.10013

Splash: splash10-014i-0090000000-ba3ffa63fa98816cf431

m/z	Int.	NL	Rel.Int.
217.03	17018	162	1000

FlavonoidSearch結果

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Dihydrochalcone]-A(2OH, 1OMe, 1(2-hydroxybenzyl))-B(none)	Dihydrochalcone	Isouvaretin
[Dihydrochalcone]-A(2OH, 1OMe, 1(2-hydroxybenzyl))-B(none)	Dihydrochalcone	Uvaretin
[Dihydrochalcone]-A(2OH, 1OMe, 1(2-hydroxybenzyl))-B(none)	Dihydrochalcone	2',6'-Dihydroxy-4'-methoxy-3'-(2-hydroxybenzyl)dihydrochalcone
[Flavanone]-A(1OH, 1([2,3:@@]-(5,6-Dihydroxybenzofurano)))-B(1OH)	Flavanone	Anastatin A
[Flavanone]-A(1OH, 1([2,3:@@]-(5,6-Dihydroxybenzofurano)))-B(1OH)	Flavanone	Anastatin B
[Flavone]-A(1([2,3:@@]-(8,8-Dimethyl-9-hydroxy-6-oxo-1,7-dioxaspiro[4,4]non-2-ene)))-B(none)	Flavone	Glabratephrinol
[Flavone]-A(1OMe, 1([@@]-Methylenedioxy))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavone	Isopongachromene
[Flavone]-A(1OMe, 1([@@]-Methylenedioxy))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavone	5-Methoxy-6'',6''-dimethyl-3',4'-methylenedioxypyrano[2'',3'':7,8]flavone
[Flavonol (3-OMe)]-A(1([2,3:@@]-Furano))-B(1([@@]-Methylenedioxy))	Flavonol	Pongachromene
[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1Cl)	Flavonol	Chlorflavonin
[Isoflavone]-A(1([@@]-Methylenedioxy))-B(1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Isoflavone	Isojamaicin
[Isoflavone]-A(1([@@]-Methylenedioxy))-B(1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Isoflavone	Jamaicin
[Isoflavone]-A(1OMe, 1([@@]-Methylenedioxy))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Isoflavone	Durmillone
[Isoflavone]-A(1OMe, 1([@@]-Methylenedioxy))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Isoflavone	Robustone methyl ether
[Isoflavone]-A(1OMe, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(1([@@]-Methylenedioxy))	Isoflavone	Glabrescione A
[Rotenone]-A(1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(1([@@]-Methylenedioxy))	Rotenone	Isomillettone
[Rotenone]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1([@@]-Methylenedioxy))	Rotenone	Millettone