ピーク情報

チンゲンサイ葉生

pos

Peak #1916 MN MID: SE117_S061601_M90

m/z: 363.10719, RT: 39.90, 強度: 1342, ログ強度: -0.29, 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: (10 names) Methyl asterrate;8'-O-Methylasterric acid;5,7,3'-Trihydroxy-6,4',5'-trimethoxyflavanone;Crotepoxide;(+)-Crotepoxide;Flagranone B;Morintrifolin B;2,3-Dihydroirigenin;5,7,3'-Trihydroxy-6,4',5'-trimethox...

DBごとのヒット数: ALL 8 KN 8

FlavonoidSearch最大スコア MS2: 0.133, MS3: 0.158

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
C18H18O8	362.10017	-0.710	Methyl asterrate	KNApSAcK: C00044929, C00045339
C18H18O8	362.10017	-0.710	8'-O-Methylasterric acid	KNApSAcK: C00052783
C18H18O8	362.10017	-0.710	5,7,3'-Trihydroxy-6,4',5'-trimethoxyflavanone	FlavonoidViewer: FL2FEGNS0003 KNApSAcK: C00014139 LipidMAPS: LMPK12140637
C18H18O8	362.10017	-0.710	Crotepoxide	KNApSAcK: C00036940
C18H18O8	362.10017	-0.710	Flagranone B	KNApSAcK: C00015444
C18H18O8	362.10017	-0.710	Morintrifolin B	KNApSAcK: C00039796
C18H18O8	362.10017	-0.710	2,3-Dihydroirigenin	KNApSAcK: C00018954
C18H23ON2Br	362.09937	1.480	Flustramine F	KNApSAcK: C00047881

MSnスペクトル情報

Level: 2, プリカーサーm/z: 363.10678

Splash: splash10-00kb-0916000000-b0a6f5a12f57c0aec62e

m/z	Int.	NL	Rel.Int.
345.18	1019	18	1000
166.97	584	196	573
148.98	573	214	562
150.94	559	212	548
315.18	501	48	491
211.08	338	152	331
194.99	203	168	198
239.05	169	124	166
333.23	130	30	127
196.11	99	167	97
121.03	96	242	93
177.07	71	186	69
193.16	71	170	69
317.20	63	46	61
135.01	54	228	53
169.04	53	194	51
162.99	51	200	50
165.03	51	198	50

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.133	[Flavonol]-A(2OH, 1OMe)-B(2OH, 1OMe)	Flavonol	3,5,7,3',5'-Pentahydroxy-6,4'-dimethoxyflavone
0.133	[Flavonol]-A(2OH, 1OMe)-B(2OH, 1OMe)	Flavonol	Hibiscetin 8,3'-dimethyl ether
0.045	[Isoflavan]-A(1OH, 2OMe)-B(1OH, 2OMe)	Isoflavan	Machaerol B
0.036	[Flavanone]-A(2OH, 1OMe)-B(1OH, 2OMe)	Flavanone	5,7,3'-Trihydroxy-6,4',5'-trimethoxyflavanone
0.030	[Flavonol]-A(2OH, 2OMe)-B(2OH)	Flavonol	3,5,7,3',4'-Pentahydroxy-6,8-dimethoxyflavone
0.000	[Flavanone]-A(2OH, 1(2-hydroxybenzyl))-B(none)	Flavanone	Isochamanetin
0.000	[Flavanone]-A(2OH, 1(2-hydroxybenzyl))-B(none)	Flavanone	Chamanetin
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(3OH)	Flavonol	5,7,3',4',5'-Pentahydroxy-3,6-dimethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(3OH)	Flavonol	5,7,2',3',4'-Pentahydroxy-3,6-dimethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(3OH)	Flavonol	5,8,3',4',5'-Pentahydroxy-3,7-dimethoxyflavone
0.000	[Flavonol (3-OMe)]-A(3OH, 1OMe)-B(2OH)	Flavonol	5,7,8,3',4'-Pentahydroxy-3,6-dimethoxyflavone
0.000	[Flavan 3-ol]-A(2OH, 1OMe)-B(2OH)-C(1(O-Acetyl))	Flavan 3-ol	3,7,8,3',4'-Pentahydroxy-5-methoxyflavan 3-O-acetate

Level: 3, プリカーサーm/z: 345.18332

Splash: splash10-02t9-0319000000-d7b1bbad684bc17b835d

m/z	Int.	NL	Rel.Int.
315.10	331	30	1000
313.17	288	32	869
177.09	158	168	476
151.08	57	194	173
221.14	53	124	158
299.25	24	46	73

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.158	[Flavonol]-A(1OMe)-B(1OH, 2OMe)	Flavonol	3,4'-Dihydroxy-7,3',5'-trimethoxyflavone
0.130	[Isoflavone]-A(1OH, 1OMe)-B(1OH, 2OMe)	Isoflavone	Derrugenin
0.130	[Isoflavone]-A(1OH, 2OMe)-B(1OH, 1OMe)	Isoflavone	5,3'-Dihydroxy-7,8,2'-trimethoxyisoflavone
0.130	[Isoflavone]-A(2OH, 1OMe)-B(2OMe)	Isoflavone	Junipegenin B
0.130	[Isoflavone]-A(2OH, 1OMe)-B(2OMe)	Isoflavone	5,7-Dihydroxy-8,3',4'-trimethoxyisoflavone
0.130	[Isoflavone]-A(2OH)-B(3OMe)	Isoflavone	Panchovillin
0.105	[Anthocyanidin]-A(1OH, 1OMe)-B(1OH, 2OMe)	Anthocyanidin	3,7,4'-Trihydroxy-5,3',5'-trimethoxyflavylium
0.105	[Anthocyanidin]-A(1OH, 1OMe)-B(1OH, 2OMe)	Anthocyanidin	Hirsutidin
0.100	[Flavonol]-A(1OH, 2OMe)-B(1OMe)	Flavonol	Mikanin
0.100	[Flavonol]-A(1OH, 2OMe)-B(1OMe)	Flavonol	Tambulin
0.100	[Flavonol]-A(1OH, 1OMe)-B(2OMe)	Flavonol	3,7-Dihydroxy-5,3',4'-trimethoxyflavone
0.100	[Flavonol]-A(1OH, 1OMe)-B(2OMe)	Flavonol	Quercetin 7,3',4'-trimethyl ether
0.100	[Flavonol]-A(1OH, 3OMe)-B(none)	Flavonol	3,5-Dihydroxy-6,7,8-trimethoxyflavone
0.100	[Flavonol]-A(3OMe)-B(1OH)	Flavonol	Candidol
0.091	[Flavone]-A(2OH)-B(3OMe)	Flavone	Prosogerin E
0.091	[Flavone]-A(1OH, 1OMe)-B(1OH, 2OMe)	Flavone	8,3'-Dihydroxy-7,4',5'-trimethoxyflavone
0.091	[Flavone]-A(1OH, 1OMe)-B(1OH, 2OMe)	Flavone	5,5'-Dihydroxy-8,3',4'-trimethoxyflavone
0.091	[Flavone]-A(2OH)-B(3OMe)	Flavone	Tricetin 3',4',5'-trimethyl ether
0.091	[Flavone]-A(1OH, 1OMe)-B(1OH, 2OMe)	Flavone	Lethedocin
0.091	[Flavone]-A(1OH, 1OMe)-B(1OH, 2OMe)	Flavone	5,4'-dihydroxy-7,3',5'-trimethoxyflavone
0.091	[Flavone]-A(3OMe)-B(2OH)	Flavone	3',4'-Dihydroxy-5,6,7-trimethoxyflavone
0.091	[Flavone]-A(2OH, 1OMe)-B(2OMe)	Flavone	Eupatilin
0.091	[Flavone]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavone	Cirsilineol
0.091	[Flavone]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavone	Eupatorin
0.091	[Flavone]-A(2OH, 1OMe)-B(2OMe)	Flavone	6-Hydroxyluteolin 7,3',4'-trimethyl ether
0.091	[Flavone]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavone	Wightin
0.091	[Flavone]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavone	Rivularin (flavone)
0.091	[Flavone]-A(2OH, 1OMe)-B(2OMe)	Flavone	5,7-Dihydroxy-8,2',6'-trimethoxyflavone
0.091	[Flavone]-A(2OH, 1OMe)-B(2OMe)	Flavone	5,7-Dihydroxy-8,3',5'trimethoxyflavone
0.091	[Flavone]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavone	8,3'-Dihydroxy-5,7,4'-trimethoxyflavone
0.091	[Flavone]-A(2OH, 1OMe)-B(2OMe)	Flavone	Hypolaetin 8,3',4'-trimethyl ether
0.091	[Flavone]-A(1OH, 3OMe)-B(1OH)	Flavone	Tenaxin I
0.091	[Flavone]-A(2OH, 2OMe)-B(1OMe)	Flavone	Pedunculin
0.091	[Flavone]-A(1OH, 3OMe)-B(1OH)	Flavone	Xanthomicrol
0.091	[Flavone]-A(2OH, 2OMe)-B(1OMe)	Flavone	Nevadensin
0.091	[Flavone]-A(2OH, 2OMe)-B(1OMe)	Flavone	5,6-Dihydroxy-7,8,4'-trimethoxyflavone
0.000	[Flavanone]-A(4OMe)-B(none)	Flavanone	Kanakugin
0.000	[Flavanone]-A(3OMe)-B(1OMe)	Flavanone	5,6,7,4'-Tetramethoxyflavanone
0.000	[Flavanone]-A(2OMe)-B(2OMe)	Flavanone	5,7,2',5'-Tetramethoxyflavanone
0.000	[Flavanone]-A(2OMe)-B(2OMe)	Flavanone	Arjunone
0.000	[2'-Hydroxychalcone]-A(1OH, 3OMe)-B(1OMe)	2'-Hydroxychalcone	6'-Hydroxy-4,2',3',4'-tetramethoxychalcone
0.000	[2'-Hydroxychalcone]-A(2OH, 3OMe)-B(none)	2'-Hydroxychalcone	3'-Hydroxy-2',4',5',6'-tetramethoxychalcone
0.000	[2'-Hydroxychalcone]-A(1OH, 4OMe)-B(none)	2'-Hydroxychalcone	Kanakugiol
0.000	[2'-Hydroxychalcone]-A(1OH, 2OMe)-B(2OMe)	2'-Hydroxychalcone	Okanin 3,4,3',4'-tetramethyl ether
0.000	[2'-Hydroxychalcone]-A(1OH, 2OMe)-B(2OMe)	2'-Hydroxychalcone	2'-Hydroxy-2,3,4',6'-tetramethoxychalcone
0.000	[2'-Hydroxychalcone]-A(1OH, 2OMe)-B(2OMe)	2'-Hydroxychalcone	2'-Hydroxy-3,4,4',6'-tetramethoxychalcone
0.000	[2'-Hydroxychalcone]-A(1OH, 2OMe)-B(2OMe)	2'-Hydroxychalcone	Cerasidin
0.000	[Aurone]-A(3OMe)-B(2OH)	Aurone	Hamiltrone
0.000	[2'-Hydroxychalcone]-A(2OH, 2OMe)-B(1([@@]-Methylenedioxy))	2'-Hydroxychalcone	Agestricin A
0.000	[Dihydrochalcone]-A(3OMe)-B(1([@@]-Methylenedioxy))	Dihydrochalcone	2',4',6'-Trimethoxy-3,4-methylenedioxydihydrochalcone
0.000	[Dihydrochalcone beta-ol (2-OMe)]-A(1([@@]-Methylenedioxy))-B(2OMe)	Dihydrochalcone beta-ol	Dihydroisomilletenone methyl ether
0.000	[Dihydrochalcone beta-ol (beta-OMe)]-A(2OMe)-B(1([@@]-Methylenedioxy))	Dihydrochalcone beta-ol	Dihydromilletenone methyl ether
0.000	[Flavanone]-A(1OH, 1OMe, 1Methyl)-B(2OMe)	Flavanone	5-Hydroxy-7,3',4'-trimethoxy-6-C-methylflavanone
0.000	[Flavanone]-A(2OMe, 1Methyl)-B(1OH, 1OMe)	Flavanone	3'-Hydroxy-5,7,4'-trimethoxy-8-C-methylflavanone
0.000	[Flavanone]-A(1OH, 2OMe)-B(1([@@]-Methylenedioxy))	Flavanone	Agestricin B
0.000	[UBR-type derivative / [2',5']-Benzoquinonyl-type Flavanone]-A(1OH, 1OMe, 1Methyl)-B(1OMe)	UBR-type derivative / [2',5']-Benzoquinonyl-type Flavanone	Breverin
0.000	[Flavone]-A(1([2,3:@@]-(6,6-Dimethylpyrano)), 1([2,3:@@]-Furano))-B(none)	Flavone	Sanaganone
0.000	[Dihydroflavonol]-A(2OH)-B(1OMe)-C(1(O-Acetyl))	Dihydroflavonol	Aromadendrin 4'-methyl ether 3-O-acetate
0.000	[Dihydroflavonol]-A(1OH, 1OMe)-B(1OH)-C(1(O-Acetyl))	Dihydroflavonol	Aromadendrin 7-methyl ether 3-O-acetate
0.000	[Flavonol (3-OMe)]-A(1OMe)-B(2OH, 1OMe)	Flavonol	4',5'-Dihydroxy-3,7,3'-trimethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH)-B(2OMe)	Flavonol	Quercetin 3,3',4'-trimethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe)-B(1OH, 1OMe)	Flavonol	Quercetin 3,5,3'-trimethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe)-B(1OH, 1OMe)	Flavonol	Pachypodol
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe)-B(1OH, 1OMe)	Flavonol	Ayanin
0.000	[Flavonol (3-OMe)]-A(2OH, 1Methyl)-B(1OH, 1OMe)	Flavonol	6-C-Methylquercetin 3,3'-dimethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe, 1Methyl)-B(2OH)	Flavonol	2-(3,4-Dihydroxyphenyl)-5-hydroxy-3,7-dimethoxy-6-methyl-4H-1-benzopyran-4-one
0.000	[Flavonol (3-OMe)]-A(2OH, 2Methyl)-B(2OH)	Flavonol	2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3-methoxy-6,8-dimethyl-4H-1-benzopyran-4-one
0.000	[Flavonol (3-OMe)]-A(2OH)-B(2OMe)	Flavonol	Morin 3,2',4'-trimethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe)-B(1OH, 1OMe)	Flavonol	Morin 3,7,4'-trimethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH)	Flavonol	6-Hydroxykaempferol 3,5,7-trimethyl ether
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OMe)	Flavonol	Santin
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH)	Flavonol	Penduletin
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OMe)	Flavonol	Tanetin
0.000	[Flavonol (3-OMe)]-A(1OH, 1([@@]-Methylenedioxy))-B(2OH)	Flavonol	5,3',4'-Trihydroxy-3-methoxy-6,7-methylenedioxyflavone
0.000	[Flavonol]-A(1OH, 1([@@]-Methylenedioxy))-B(1OH, 1OMe)	Flavonol	3,5,3'-Trihydroxy-4'-methoxy-6,7-methylenedioxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH)	Flavonol	5,2'-Dihydroxy-3,7,8-trimethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OMe)	Flavonol	Herbacetin 3,7,4'-trimethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH)	Flavonol	Herbacetin 3,7,8-trimethyl ether
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OMe)	Flavonol	Herbacetin 3,8,4'-trimethyl ether
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe, 1Methyl)-B(1OH)	Flavonol	5,8,4'-Trihydroxy-3,7-dimethoxy-6-methylflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 1([@@]-Methylenedioxy))-B(2OH)	Flavonol	Wharangin
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(none)	Flavonol	5,8-Dihydroxy-3,6,7-trimethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(none)	Flavonol	Araneol
0.000	[CCS-type derivative / [3,2']-Epoxymethanoflavone]-A(2OH, 1OMe)-B(2OH)	CCS-type derivative / [3,2']-Epoxymethanoflavone	Benthamianin
0.000	[Flavan]-A(1OH, 1OMe, 2Methyl)-B(1OH, 1([@@]-Methylenedioxy))	Flavan	5,2'-Dihydroxy-7-methoxy-6,8-dimethyl-4',5'-methylenedioxyflavan
0.000	[Pterocarpan]-A(1OH, 2OMe)-B(1([@@]-Methylenedioxy))	Pterocarpan	2-Hydroxy-4-methoxypterocarpin
0.000	[Pterocarpan-6a-ol]-A(2OMe)-B(1([@@]-Methylenedioxy))	Pterocarpan-6a-ol	Lathycarpin
0.000	[Pterocarpene]-A(1OH, 1OMe)-B(1OH, 2OMe)	Pterocarpene	Bryacarpene 1
0.000	[12a-Hydroxyrotenone]-A(1OH, 1OMe, 1Methyl)-B(1OH)	12a-Hydroxyrotenone	Boeravinone C
0.000	[4-phenylcoumarin]-A(1OH, 2OMe)-B(1OH, 1OMe)	4-phenylcoumarin	8,3'-Dihydroxy-5,7,4'-trimethoxy-4-phenylcoumarin

Level: 3, プリカーサーm/z: 166.97141

Splash: splash10-0002-0900000000-85b47c518e20ed1bafa7

m/z	Int.	NL	Rel.Int.
148.99	196	18	1000
135.03	95	32	487
136.96	19	30	99
106.84	17	60	88
125.06	15	42	75