ピーク情報

タバコBY-2細胞　3日目

pos

Peak #1633 MN MID: SE204_S03_M90

m/z: 257.13172, RT: 47.48, 強度: 2024, ログ強度: -0.09, 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: (5 names) 5,6-Dimethylbenzanthracene;Benz(a)anthracene, 9,10-dimethyl-;Benz(a)anthracene, 1,2-dimethyl-;Triphenylethylene;7,12-Dimethylbenz[a]anthracene

DBごとのヒット数: ALL 5 KG 2 HM 3

FlavonoidSearch最大スコア MS2: 0.143, MS3: 0.235

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
C20H16	256.12520	-2.936	5,6-Dimethylbenzanthracene	HMDB: HMDB0246863
C20H16	256.12520	-2.936	Benz(a)anthracene, 9,10-dimethyl-	HMDB: HMDB0248968
C20H16	256.12520	-2.936	Benz(a)anthracene, 1,2-dimethyl-	HMDB: HMDB0248967
C20H16	256.12520	-2.936	Triphenylethylene	HMDB: HMDB0259263 KEGG: C14134
C20H16	256.12520	-2.936	7,12-Dimethylbenz[a]anthracene	HMDB: HMDB0062429 KEGG: C19488

MSnスペクトル情報

Level: 2, プリカーサーm/z: 257.13150

Splash: splash10-014i-0910000000-3d6eca2b1844c51658b3

m/z	Int.	NL	Rel.Int.
167.88	8345	89	1000
239.02	980	18	117
239.76	843	17	101
136.03	490	121	58

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.143	[Dihydroflavonol]-A(1OH)-B(none)	Dihydroflavonol	3,7-dihydroxyflavanone
0.083	[2'-Hydroxychalcone]-A(3OH)-B(none)	2'-Hydroxychalcone	2',4',6'-Trihydroxychalcone
0.083	[Isoflavanone]-A(1OH)-B(1OH)	Isoflavanone	Dihydrodaidzein
0.077	[Flavanone]-A(2OH)-B(none)	Flavanone	Pinocembrin
0.067	[2'-Hydroxychalcone]-A(1OH)-B(2OH)	2'-Hydroxychalcone	3,4,2'-Trihydroxychalcone
0.067	[2'-Hydroxychalcone]-A(2OH)-B(1OH)	2'-Hydroxychalcone	Isoliquiritigenin
0.067	[2'-Hydroxychalcone]-A(2OH)-B(1OH)	2'-Hydroxychalcone	4,2',5'-Trihydroxychalcone
0.067	[2'-Hydroxychalcone]-A(2OH)-B(1OH)	2'-Hydroxychalcone	4,2',3'-Trihydroxychalcone
0.063	[Flavanone]-A(1OH)-B(1OH)	Flavanone	Liquiritigenin
0.000	[Dihydrochalcone]-A(1OH, 1OMe)-B(none)	Dihydrochalcone	2'-Hydroxy-4'-methoxydihydrochalcone
0.000	[Dihydrochalcone]-A(1OH, 1OMe)-B(none)	Dihydrochalcone	2'-Methoxy-4'-hydroxydihydrochalcone
0.000	[Dihydrochalcone]-A(none)-B(1OH, 1OMe)	Dihydrochalcone	2-Methoxy-4-hydroxydihydrochalcone
0.000	[Pterocarpan]-A(1OH)-B(1OH)	Pterocarpan	Demethylmedicarpin
0.000	[Aurone]-A(none)-B(1Cl)	Aurone	4'-Chloroaurone
0.000	[UBR-type derivative / 2',5'-Dioxo-3'-cyclopentenyl-type Calcone]-A(1OMe)-B(none)	UBR-type derivative / 2',5'-Dioxo-3'-cyclopentenyl-type Calcone	Lucidone
0.000	[Flavan]-A(1OH)-B(1OMe)	Flavan	Broussin
0.000	[Flavan]-A(1OMe)-B(1OH)	Flavan	4'-Hydroxy-7-methoxyflavan
0.000	[Flavan]-A(1OH, 1Methyl)-B(1OH)	Flavan	7,4'-Dihydroxy-8-methylflavan
0.000	[Flavan]-A(1OH, 1OMe)-B(none)	Flavan	7-Hydroxy-5-methoxyflavan
0.000	[isoflavene]-A(1OH)-B(2OH)	isoflavene	Haginin D
0.000	[2-Phenylbenzofuran]-A(1OH)-B(1OH, 1OMe)	2-Phenylbenzofuran	6-Demethylvignafuran
0.000	[2-Phenylbenzofuran]-A(1OH)-B(1OH, 1OMe)	2-Phenylbenzofuran	Centrolobofuran
0.000	[Dalbergiquinol]-A(2OH, 1OMe)-B(none)	Dalbergiquinol	Obtusaquinol

Level: 3, プリカーサーm/z: 167.87982

Splash: splash10-03di-0900000000-12eab8488eb0482f5538

m/z	Int.	NL	Rel.Int.
111.83	2904	56	1000
134.95	373	33	128
150.95	155	17	53

Level: 3, プリカーサーm/z: 239.01506

Splash: splash10-00di-0290000000-737e43f268974259c4be

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.235	[Chalcone]-A(1OMe)-B(none)	Chalcone	4'-Methoxychalcone
0.167	[Flavone]-A(none)-B(1OH)	Flavone	2'-Hydroxyflavone
0.167	[Flavone]-A(1OH)-B(none)	Flavone	Primuletin
0.000	[Aurone]-A(none)-B(1OH)	Aurone	2'-Hydroxyaurone

m/z	Int.	NL	Rel.Int.
222.04	126	17	1000
220.98	63	18	505
207.15	17	32	134
210.99	14	28	109
203.11	13	36	107
160.96	13	78	100
141.02	13	98	100
122.95	11	116	87
193.15	10	46	77
155.03	10	84	76
180.86	7	58	55