ピーク情報

はつか大根　葉

pos

Peak #9033 MN MID: SE202_S21_M90

m/z: 581.16387, RT: 61.85, 強度: 18966, ログ強度: 0.82, アダクト: [M+K]+, 共有数（同様のピークを含むサンプル数）: 1

DB検索結果: (3 names) 6-O-(3,4,5-trimethoxybenzoyl)-ajugol;Deoxyloganin tetraacetate;Lucidumoside B

DBごとのヒット数: ALL 3 KG 1 KN 2

FlavonoidSearch最大スコア MS2: -, 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
C25H34O13	542.19994	1.429	6-O-(3,4,5-trimethoxybenzoyl)-ajugol	KNApSAcK: C00035510
C25H34O13	542.19994	1.429	Deoxyloganin tetraacetate	KEGG: C11646, C11650 LipidMAPS: LMPR0102070019, LMPR0102070021
C25H34O13	542.19994	1.429	Lucidumoside B	KNApSAcK: C00033127

Level: 2, プリカーサーm/z: 581.16260

Splash: splash10-000i-0000090000-597f76b763097c8f7284

m/z	Int.	NL	Rel.Int.
537.25	5387	44	1000

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(2OH, 1(C-Glu), 1(C-Xylosyl))-B(2OH)	Flavone	Lucenin 1
[Flavone]-A(2OH, 1(C-Glu), 1(C-Xylosyl))-B(2OH)	Flavone	Lucenin 3
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(2OH)	Flavone	Carlinoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(2OH)	Flavone	Isocarlinoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(2OH)	Flavone	Neocarlinoside

Level: 3, プリカーサーm/z: 537.24738

Splash: splash10-0002-0000900000-0ddff5ea2fa3fe0b1aeb

m/z	Int.	NL	Rel.Int.
495.34	570	42	1000

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.000	[Flavone]-A(2OH, 1OMe, 1(C-Glu))-B(3OMe)	Flavone	5,7-Dihydroxy-8,3',4',5'-tetramethoxyflavone 6-C-glucoside
0.000	[Isoflavone]-A(2OH, 1OMe, 1(C-Glu))-B(3OMe)	Isoflavone	Dalpaniculin

ピーク番号	保持時間 (min)	m/z	m/z差分	ログ強度	アダクト	DB検索結果	ヒット数	MSn	共有数
	61.86	588.26585	7.1020	0.30	[M+C2H7N+H]+	(3 names) 6-O-(3,4,5-trimethoxybenzoyl)-ajugol; Deoxyloganin tetraacetate; Lucidumoside B	ALL 3 KG 1 KN 2	MS2	1
9033	61.85	581.16387	0.0000	0.82	[M+K]+	(3 names) 6-O-(3,4,5-trimethoxybenzoyl)-ajugol; Deoxyloganin tetraacetate; Lucidumoside B	ALL 3 KG 1 KN 2	MS2 MS3	1
	61.85	560.23399	-20.9299	1.81	[M+NH4]+	(3 names) 6-O-(3,4,5-trimethoxybenzoyl)-ajugol; Deoxyloganin tetraacetate; Lucidumoside B	ALL 3 KG 1 KN 2	MS2 MS3	5
	61.86	543.20743	-37.9564	1.73	[M+H]+	(3 names) 6-O-(3,4,5-trimethoxybenzoyl)-ajugol; Deoxyloganin tetraacetate; Lucidumoside B	ALL 3 KG 1 KN 2		5
	61.85	525.19721	-55.9667	0.96	[M-H2O+H]+	(3 names) 6-O-(3,4,5-trimethoxybenzoyl)-ajugol; Deoxyloganin tetraacetate; Lucidumoside B	ALL 3 KG 1 KN 2		2