ピーク情報

（にら類）にら葉生

pos

Peak #1846 MN MID: SE114_S062071_M90

m/z: 297.05739, RT: 29.95, 強度: 3982, ログ強度: 0.30, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 3

DB検索結果: (2 names) N-Acetyldjenkolic acid;Disulfiram

DBごとのヒット数: ALL 2 KG 1 HM 1

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
C9H16O5N2S2	296.05006	0.157	N-Acetyldjenkolic acid	HMDB: HMDB0029421
C10H20N2S4	296.05093	-2.778	Disulfiram	HMDB: HMDB0014960 KEGG: C01692

Level: 2, プリカーサーm/z: 297.05692

Splash: splash10-014i-0900000000-ee03d75470b956bbb2c0

m/z	Int.	NL	Rel.Int.
167.88	3938	129	1000
150.89	781	146	198
280.10	349	17	88

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Coumestan]-A(1OMe)-B(1OMe)	Coumestan	Coumestrol dimethyl ether
[Flavone]-A(1OMe)-B(1([@@]-Methylenedioxy))	Flavone	Milleyanaflavone
[Flavone]-A(2OMe, 1Methyl)-B(none)	Flavone	5,7-Dimethoxy-6-C-methylflavone
[Flavone]-A(1OH, 1OMe, 2Methyl)-B(none)	Flavone	Desmosflavone
[Flavone]-A(2OH, 1Formyl, 1Methyl)-B(none)	Flavone	Unonal
[Flavone]-A(2OH, 1Formyl, 1Methyl)-B(none)	Flavone	Isounonal
[Flavone]-A(1OMe, 1([@@]-Methylenedioxy))-B(none)	Flavone	5-Methoxy-6,7-methylenedioxyflavone
[Flavone]-A(1OMe, 1([@@]-Methylenedioxy))-B(none)	Flavone	5-Methoxy-7,8-methylenedioxyflavone
[UBR-type derivative / 7-Oxocyclohexa-4a,5-dienyl-type Flavone]-A(1OH, 3Methyl)-B(none)	UBR-type derivative / 7-Oxocyclohexa-4a,5-dienyl-type Flavone	Dasytrichone
[Isoflavone]-A(1OMe)-B(1([@@]-Methylenedioxy))	Isoflavone	Pseudobaptigenin methyl ether
[Isoflavone]-A(1([@@]-Methylenedioxy))-B(1OMe)	Isoflavone	Maximaisoflavone H
[Pterocarpene]-A(1OMe)-B(1([@@]-Methylenedioxy))	Pterocarpene	Anhydropisatin
[Coumestan]-A(1OH)-B(1([@@]-Methylenedioxy))	Coumestan	Medicagol

Level: 3, プリカーサーm/z: 167.88086

Splash: splash10-0udi-0900000000-4719fdd77c3350d34e5d

m/z	Int.	NL	Rel.Int.
150.82	1671	17	1000

Level: 3, プリカーサーm/z: 150.89487

Splash: splash10-0059-9500000000-288e1affbd5ad31433e1

m/z	Int.	NL	Rel.Int.
78.81	75	72	1000
132.90	52	18	691
73.10	6	78	76