ピーク情報

トマト Micro-Tom 花

pos

Peak #11600 MN MID: SE203_S31_M90

m/z: 397.25839, RT: 67.78, 強度: 4101, ログ強度: -0.04, 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: (8 names) Australin A;(-)-Australin A;methyl 8-[3,5-epidioxy-2-(3-hydroperoxy-1-pentenyl)-cyclopentyl]-octanoate;Rollicosin;(-)-Rollicosin;9S,15S-dihydroxy-11R-acetoxy-5Z,13E-prostadienoic acid;ent-13R,15-Dihyd...

DBごとのヒット数: ALL 6 KN 4 LM 2

FlavonoidSearch最大スコア MS2: 0.091, 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
C22H36O6	396.25119	-0.198	Australin A	KNApSAcK: C00042256
C22H36O6	396.25119	-0.198	methyl 8-[3,5-epidioxy-2-(3-hydroperoxy-1-pentenyl)-cyclopentyl]-octanoate	LipidMAPS: LMFA01040054
C22H36O6	396.25119	-0.198	Rollicosin	KNApSAcK: C00045046
C22H36O6	396.25119	-0.198	9S,15S-dihydroxy-11R-acetoxy-5Z,13E-prostadienoic acid	LipidMAPS: LMFA03010096
C22H36O6	396.25119	-0.198	ent-13R,15-Dihydroxy-14S-acetoxy-1(10)-halimen-18-oic acid	KNApSAcK: C00023453
C22H36O6	396.25119	-0.198	3-[8-[(Acetyloxy)methyl]-13-hydroxy-4-(hydroxymethyl)-12-methyl-11-tridecenyl]-2(5H)-furanone	KNApSAcK: C00022126

MSnスペクトル情報

Level: 2, プリカーサーm/z: 397.25836

Splash: splash10-004i-0009000000-4e7b4161806b84a8819b

m/z	Int.	NL	Rel.Int.
379.41	2216	18	1000
378.67	204	19	92

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.091	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(3OMe)	2'-Hydroxychalcone	Glabrachalcone
0.091	[2'-Hydroxychalcone]-A(1OH, 1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OMe)	2'-Hydroxychalcone	Ponganone VI
0.091	[2'-Hydroxychalcone]-A(1OH, 1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OMe)	2'-Hydroxychalcone	Glychalcone B
0.091	[2'-Hydroxychalcone]-A(1OH, 1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OMe)	2'-Hydroxychalcone	6'',6''-Dimethylpyrano[2'',3'':6',5']-2'-hydroxy-3,4,4'-trimethoxychalcone
0.083	[Flavanone]-A(1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OMe)	Flavanone	Ponganone IV
0.083	[Flavanone]-A(1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OMe)	Flavanone	Glyflavanone B
0.048	[Isoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 2OMe)	Isoflavone	Elongatin
0.045	[Isoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 2OMe)	Isoflavone	Pumilaisoflavone D
0.000	[Flavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 2OMe)	Flavone	5-Hydroxy-8-(4-hydroxy-3,5-dimethoxyphenyl)-2,2-dimethyl-2H,6H-benzo[1,2-b:5,4-b']dipyran-6-one
0.000	[2'-Hydroxychalcone]-A(1OH, 2OMe, 1(C-Prenyl))-B(1([@@]-Methylenedioxy))	2'-Hydroxychalcone	Ovalichalcone A
0.000	[beta-Hydroxy(or Oxodihydro)chalcone]-A(2OMe, 1(C-Prenyl))-B(1([@@]-Methylenedioxy))	beta-Hydroxy(or Oxodihydro)chalcone	Pongagallone B
0.000	[Flavone]-A(1OH, 1OMe, 1(C-Prenyl))-B(2OH, 2Methyl)	Flavone	Muxiangrin III
0.000	[CCS-type derivative / [2',3]-Isopropenylethanoflavone]-A(1OH, 1OMe)-B(2OH, 1OMe)	CCS-type derivative / [2',3]-Isopropenylethanoflavone	Artoindonesianin S
0.000	[CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone]-A(1OH, 1OMe)-B(1OH, 1OMe)	CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone	Artonin L
0.000	[Flavonol (3-OMe)]-A(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(1OH, 1OMe)	Flavonol	Velloquercetin 3,3'-dimethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 1Methyl, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(2OH)	Flavonol	8-C-Methylvelloquercetin 3-methyl ether
0.000	[Flavonol (3-OMe)]-A(2OMe, 1([2,3:@@]-Furano))-B(1([@@]-Methylenedioxy))	Flavonol	3,5,6-Trimethoxy-3',4'-methylene-dioxyfurano[2,3:7,8]flavone
0.000	[Isoflavone]-A(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(1OH, 2OMe)	Isoflavone	5,4'-Dihydroxy-3',5'-dimethoxy-(5''-Isopropenyldihydrofurano)[2'',3'':7,6]isoflavone
0.000	[Pterocarpan]-A(2OMe, 1(C-Prenyl))-B(1([@@]-Methylenedioxy))	Pterocarpan	Neoraucarpan
0.000	[Rotenone]-A(1([2,3:@@]-(5-(1-Hydroxymethylvinyl)dihydrofurano)))-B(1OH, 1OMe)	Rotenone	3-O-Demethylamorphigenin
0.000	[Rotenone]-A(1OH, 1(C-Prenyl))-B(2OMe)	Rotenone	Rotenonic acid
0.000	[4-Benzoylchroman]-A(2OMe)-B(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))	4-Benzoylchroman	Rotenol