ピーク情報

こまつな葉生

pos

Peak #211 MN MID: SE114_S060861_M90

m/z: 390.94741, RT: 10.68, 強度: 2883, ログ強度: 0.07, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 19

DB検索結果: Triclabendazole sulfone

DBごとのヒット数: ALL 1 HM 1

FlavonoidSearch最大スコア MS2: 0.118, MS3: 0.077

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
C14H9O3N2SCl3	389.93995	0.467	Triclabendazole sulfone	HMDB: HMDB0259182

MSnスペクトル情報

Level: 2, プリカーサーm/z: 390.94644

Splash: splash10-0a4i-0039000005-9773725569bc466b23bd

m/z	Int.	NL	Rel.Int.
306.97	2150	84	1000
223.08	673	168	313
1953.47	397	-1563	184
1994.43	350	-1603	162
207.11	282	184	131
1986.87	277	-1596	128
1929.77	234	-1539	108
1968.26	148	-1577	68

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.118	[Flavanone]-A(1OH, 2OMe)-B(3OMe)	Flavanone	5-Hydroxy-6,7,3',4',5'-pentamethoxyflavanone
0.000	[Flavone]-A(1OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	Flavone	Kanzonol E
0.000	[Flavone]-A(1OH, 3OMe)-B(2OH, 1OMe)	Flavone	Gardenin E
0.000	[Flavone]-A(2OH, 2OMe)-B(1OH, 2OMe)	Flavone	Scaposin
0.000	[Flavone]-A(1OH, 3OMe)-B(2OH, 1OMe)	Flavone	Agecorynin D
0.000	[Flavonol]-A(1OH, 2OMe)-B(1OH, 2OMe)	Flavonol	3,5,3'-Trihydroxy-6,7,4',5'-tetramethoxyflavone
0.000	[Flavonol]-A(1OH, 3OMe)-B(1OH, 1OMe)	Flavonol	3,5,4'-Trihydroxy-6,7,8,3'-tetramethoxyflavone
0.000	[Flavonol]-A(1OH, 3OMe)-B(1OH, 1OMe)	Flavonol	3,5,3'-Trihydroxy-6,7,8,4'-tetramethoxyflavone
0.000	[Flavonol]-A(2OH, 2OMe)-B(2OMe)	Flavonol	3,5,8-Trihydroxy-6,7,3',4'-tetramethoxyflavone
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))-B(1OH)	2'-Hydroxychalcone	Lespeol
0.000	[2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	2'-Hydroxychalcone	Paratocarpin C
0.000	[2'-Hydroxychalcone]-A(2OH)-B(1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))	2'-Hydroxychalcone	Anthyllisone
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1(C-Prenyl))	2'-Hydroxychalcone	Paratocarpin B
0.000	[2'-Hydroxychalcone]-A(1OH, 1([3,4,5:@@@]-(1,7,7-Trimethyl-2,6-dioxa-tricyclo[6.2.2.0(4,9)]dodecene)))-B(none)	2'-Hydroxychalcone	Rubranine
0.000	[Flavanone]-A(1OH)-B(1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Abyssinone III
0.000	[Flavanone]-A(1OH, 1(C-Prenyl))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Euchrenone a5
0.000	[Flavanone]-A(1OH, 1(C-Prenyl))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Dinklagin A
0.000	[Flavanone]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1(C-Prenyl))	Flavanone	Shinflavanone
0.000	[Flavanone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	Flavanone	Fulvinervin A
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OH, 2OMe)	Flavonol	5,7,4'-Trihydroxy-3,6,3',5'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OH, 2OMe)	Flavonol	5,7,3'-Trihydroxy-3,6,4',5'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(2OH, 1OMe)	Flavonol	5,3',5'-Trihydroxy-3,6,7,4'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OH, 2OMe)	Flavonol	Apuleitrin
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OH, 2OMe)	Flavonol	5,7,5'-Trihydroxy-3,6,2',4'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OH, 2OMe)	Flavonol	5,7,2'-Trihydroxy-3,6,4',5'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(2OH, 1OMe)	Flavonol	5-O-Demethylapulein
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OH, 2OMe)	Flavonol	5,6,5'-Trihydroxy-3,7,2',4'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(2OH, 1OMe)	Flavonol	Hibiscetin 3,7,8,4'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OH, 2OMe)	Flavonol	Hibiscetin 3,8,3',4'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(2OH, 1OMe)	Flavonol	5,2',4'-Trihydroxy-3,7,8,5'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 3OMe)-B(2OH)	Flavonol	5,3',4'-Trihydroxy-3,6,7,8-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(1OH, 1OMe)	Flavonol	5,7,4'-Trihydroxy-3,6,8,3'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(1OH, 1OMe)	Flavonol	5,7,3'-Trihydroxy-3,6,8,4'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(1OH, 1OMe)	Flavonol	5,6,3'-Trihydroxy-3,7,8,4'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 3OMe)-B(2OH)	Flavonol	5,2',4'-Trihydroxy-3,6,7,8-tetramethoxyflavone
0.000	[Isoflavan]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Isoflavan	Hispaglabridin B
0.000	[UBR-type derivative / [2',5']-Benzoquinonyl-type Isoflavan]-A(3OMe)-B(2OMe)	UBR-type derivative / [2',5']-Benzoquinonyl-type Isoflavan	Abruquinone B
0.000	[Pterocarpan]-A(1OH, 1(C-Prenyl))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Pterocarpan	Folitenol
0.000	[Pterocarpan]-A(1([2,3:@@]-(6,6-Dimethyldihydropyrano)))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Pterocarpan	Folinin
0.000	[Pterocarpan]-A(1OH, 1(C-Prenyl))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Pterocarpan	Erybraedin D
0.000	[Pterocarpan]-A(1OH, 1(C-Prenyl))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Pterocarpan	Erybraedin B
0.000	[Pterocarpene]-A(1OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	Pterocarpene	Erycristagallin
0.000	[6,12a-Hydroxyrotenone]-A(1OH, 1OMe)-B(2OMe)	6,12a-Hydroxyrotenone	Clitoriacetal
0.000	[4-phenylcoumarin]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1Butyroyl)-B(none)	4-phenylcoumarin	6-Butyryl-5-hydroxy-4-phenylseselin
0.000	[4-phenylcoumarin]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1Isobutyroyl)-B(none)	4-phenylcoumarin	Mesuagin

Level: 3, プリカーサーm/z: 306.96765

Splash: splash10-00di-0090000000-6acf573c111165e413d4

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.077	[Flavanone]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	Flavanone	Isolonchocarpin
0.077	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	2'-Hydroxychalcone	Lonchocarpin
0.000	[Flavan 3-ol]-A(2OH)-B(3OH)	Flavan 3-ol	Gallocatechin
0.000	[Aurone]-A(1([2,3:@@]-Furano))-B(1([@@]-Methylenedioxy))	Aurone	3',4'-Methylenedioxyfurano[2'',3'':6,7]aurone
0.000	[Flavan 3,4-diol]-A(1OH)-B(3OH)	Flavan 3,4-diol	3,4,7,3',4',5'-Hexahydroxyflavan
0.000	[Flavan 3,4-diol]-A(2OH)-B(2OH)	Flavan 3,4-diol	3,4,7,8,3',4'-Hexahydroxyflavan
0.000	[Flavan 3,4-diol]-A(2OH)-B(2OH)	Flavan 3,4-diol	Catechin-4-ol
0.000	[Pterocarpene]-A(1([2,3:@@]-Furano))-B(1([@@]-Methylenedioxy))	Pterocarpene	Neoduleen