ピーク情報

ミヤコグサ

pos

Peak #5307 MN MID: SE205_S07_M90

m/z: 362.13471, RT: 55.57, 強度: 154669, ログ強度: 1.69, 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: Pyriminobac-methyl

DBごとのヒット数: ALL 1 KG 1

FlavonoidSearch最大スコア MS2: -, MS3: 0.231

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
C17H19O6N3	361.12739	0.141	Pyriminobac-methyl	HMDB: HMDB0040546, HMDB0259414 KEGG: C18486

MSnスペクトル情報

Level: 2, プリカーサーm/z: 362.13434

Splash: splash10-001i-0291000000-0abaa6bd87c3d3461d90

m/z	Int.	NL	Rel.Int.
231.10	436647	131	1000
257.01	100802	105	230
158.98	69734	203	159
344.06	42902	18	98
185.00	36985	177	84
187.06	34672	175	79
316.02	24915	46	57

Level: 3, プリカーサーm/z: 231.00827

Splash: splash10-053r-0900000000-b83b3ab286a3a4a23610

m/z	Int.	NL	Rel.Int.
184.99	68382	46	1000
158.97	46140	72	674
194.95	15091	36	220
187.09	8500	44	124
213.03	4334	18	63
130.04	3749	101	54
203.10	3697	28	54

Level: 3, プリカーサーm/z: 257.03540

Splash: splash10-01ri-0390000000-613d64aeaf2c8540dbd4

m/z	Int.	NL	Rel.Int.
213.03	13045	44	1000
239.02	9504	18	728
229.12	8585	28	658
185.02	5993	72	459
195.99	4968	61	380
168.01	1925	89	147
211.08	1296	46	99

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.231	[Isoflavanone]-A(1OH)-B(1OH)	Isoflavanone	Dihydrodaidzein
0.188	[2'-Hydroxychalcone]-A(1OH)-B(2OH)	2'-Hydroxychalcone	3,4,2'-Trihydroxychalcone
0.188	[2'-Hydroxychalcone]-A(2OH)-B(1OH)	2'-Hydroxychalcone	Isoliquiritigenin
0.188	[2'-Hydroxychalcone]-A(2OH)-B(1OH)	2'-Hydroxychalcone	4,2',5'-Trihydroxychalcone
0.188	[2'-Hydroxychalcone]-A(2OH)-B(1OH)	2'-Hydroxychalcone	4,2',3'-Trihydroxychalcone
0.176	[Flavanone]-A(1OH)-B(1OH)	Flavanone	Liquiritigenin
0.100	[Dihydroflavonol]-A(1OH)-B(none)	Dihydroflavonol	3,7-dihydroxyflavanone
0.083	[Pterocarpan]-A(1OH)-B(1OH)	Pterocarpan	Demethylmedicarpin
0.067	[2'-Hydroxychalcone]-A(3OH)-B(none)	2'-Hydroxychalcone	2',4',6'-Trihydroxychalcone
0.063	[Flavanone]-A(2OH)-B(none)	Flavanone	Pinocembrin
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	[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