ピーク情報

ポプラ, 幼植物, 地上部

pos

Peak #7469 MN MID: SE205_S08_M90

m/z: 429.11820, RT: 65.48, 強度: 3318, ログ強度: -0.08, 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: (9 names) epsilon-Rhodomycinone;Venkatasin;Catechin 3-O-(1-hydroxy-6-oxo-2-cyclohexene-1-carboxylate);Tambulin 3,5-diacetata;3,5-Diacetyltambulin;3,5-Bis(acetyloxy)-7,8-dimethoxy-2-(4-methoxyphenyl)-4H-1-benzop...

DBごとのヒット数: ALL 6 KG 1 KN 5

FlavonoidSearch最大スコア MS2: 0.059, MS3: 0.043

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
C22H20O9	428.11073	0.440	epsilon-Rhodomycinone	KEGG: C12425 KNApSAcK: C00043491
C22H20O9	428.11073	0.440	Venkatasin	KNApSAcK: C00032478
C22H20O9	428.11073	0.440	Catechin 3-O-(1-hydroxy-6-oxo-2-cyclohexene-1-carboxylate)	FlavonoidViewer: FL63ACNS0024 KNApSAcK: C00008898 LipidMAPS: LMPK12020108
C22H20O9	428.11073	0.440	Tambulin 3,5-diacetata	FlavonoidViewer: FL5FFANS0025 KNApSAcK: C00013832 LipidMAPS: LMPK12113173
C22H20O9	428.11073	0.440	2-Hydroxyaklavinone	KNApSAcK: C00018356
C22H20O9	428.11073	0.440	Hyosgerin	KNApSAcK: C00030499

MSnスペクトル情報

Level: 2, プリカーサーm/z: 429.11786

Splash: splash10-03di-0700900000-884dfaf2617019aadee3

m/z	Int.	NL	Rel.Int.
411.13	3246	18	1000
163.01	2585	266	796
144.97	178	284	54

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.059	[Flavanone]-A(1OH, 1OMe, 1(C-Prenyl))-B(3OMe)	Flavanone	Heteroflavanone B
0.000	[Flavan 3-ol]-A(2OH)-B(2OH)-C(1(O-<1-Hydroxy-6-oxo-2-cyclohexene-1-carbonyl>))	Flavan 3-ol	Catechin 3-O-(1-hydroxy-6-oxo-2-cyclohexene-1-carboxylate)
0.000	[Rotenone]-A(1([2,3:@@]-(5-(1,2-Dihydroxy-1-methylethyl)dihydrofurano)))-B(2OMe)	Rotenone	Amorphigenol
0.000	[12a-Hydroxyrotenoid 12-ol]-A(1([2,3:@@]-(5-(1-Hydroxymethylvinyl)dihydrofurano)))-B(2OMe)	12a-Hydroxyrotenoid 12-ol	12-Dihydrodalbinol

Level: 3, プリカーサーm/z: 163.00993

Splash: splash10-0006-0900000000-67f1e0204a47d6b85f87

m/z	Int.	NL	Rel.Int.
144.90	831	18	1000
134.99	88	28	105

Level: 3, プリカーサーm/z: 411.12729

Splash: splash10-03di-0911000000-a3e3d884155a90976124

m/z	Int.	NL	Rel.Int.
163.06	351	248	1000
230.97	66	180	186
392.99	41	18	117

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.043	[Isoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(3OMe)	Isoflavone	Toxicarolisoflavone
0.037	[Isoflavone]-A(1OMe, 1(C-Prenyl))-B(3OMe)	Isoflavone	Prebarbigerone
0.000	[Flavan 3-ol]-A(2OH)-B(2OH)-C(1(O-p-Hydroxybenzoyl))	Flavan 3-ol	Catechin 3-O-p-hydroxybenzoate
0.000	[beta-Hydroxy(or Oxodihydro)chalcone]-A(2OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1([@@]-Methylenedioxy))	beta-Hydroxy(or Oxodihydro)chalcone	Pongapinone A
0.000	[Dihydrochalcone]-A(2OH)-B(2OH, 1Geranyl)	Dihydrochalcone	2-Geranyl-3,4,2',4'-tetrahydroxydihydrochalcone
0.000	[Dihydrochalcone]-A(3OH)-B(1OH, 2(C-Prenyl))	Dihydrochalcone	4,2',4',6'-Tetrahydroxy-3,5-diprenyldihydrochalcone
0.000	[Dihydrochalcone alpha-ol]-A(2OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	Dihydrochalcone alpha-ol	Kanzonol Y
0.000	[UBR-type derivative / 2'-Oxocyclohexa-4',6'-dienyl-type Dihydrochalcone]-A(3OH, 2(C-Prenyl))-B(none)	UBR-type derivative / 2'-Oxocyclohexa-4',6'-dienyl-type Dihydrochalcone	3',4',6'-Trihydroxy-2'-oxo-3',5'-diprenyldihydrochalcone
0.000	[Dihydroflavonol]-A(2OH, 1(p-Hydroxybenzyl))-B(2OH)	Dihydroflavonol	Gericudranin C
0.000	[Dihydroflavonol]-A(2OH, 1(p-Hydroxybenzyl))-B(2OH)	Dihydroflavonol	Gericudranin B
0.000	[Flavonol (3-OMe)]-A(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(2OMe)	Flavonol	Velloquercetin 3,3',4'-trimethyl ether
0.000	[Flavonol (3-OMe)]-A(1OMe, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(1OH, 1OMe)	Flavonol	Velloquercetin 3,5,3'-trimethyl ether
0.000	[Isoflavone]-A(1OH, 1(C-Prenyl))-B(2OMe, 1([@@]-Methylenedioxy))	Isoflavone	Preferrugone
0.000	[Isoflavone]-A(1OH, 2OMe, 1(C-Prenyl))-B(1([@@]-Methylenedioxy))	Isoflavone	Pre-5-methoxydurmillone
0.000	[Rotenone]-A(1([2,3:@@]-(5-(1-Hydroxymethylvinyl)dihydrofurano)))-B(2OMe)	Rotenone	Amorphigenin
0.000	[Rotenone]-A(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(2OMe)	Rotenone	Sumatrol
0.000	[Rotenone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OMe)	Rotenone	Toxicarol
0.000	[6-Hydroxyrotenone]-A(1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(2OH)	6-Hydroxyrotenone	2,3,6-Trihydroxy-5''-isopropenyldihydrofurano[2'',3'':9,8]rotenone
0.000	[12a-Hydroxyrotenone]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OMe)	12a-Hydroxyrotenone	Tephrosin
0.000	[Dehydrorotenone]-A(1([2,3:@@]-(5-(Hydroxyisopropanyl)dihydrofurano)))-B(2OMe)	Dehydrorotenone	Dehydrodalpanol