ピーク情報

リーフレタスグリーン

pos

Peak #12032 MN MID: SE198_S12_M90

m/z: 448.21800, RT: 79.64, 強度: 4533, ログ強度: 0.16, アダクト: [M+NH4]+, 共有数（同様のピークを含むサンプル数）: 1

DB検索結果: (2 names) 9S-(beta-D-glucopyranosyloxy)-4,10R-dimethyl-2E,4E,6E-dodecene-1,12-dioic acid;Phenethyl rutinoside

DBごとのヒット数: ALL 2 HM 1 LM 1

FlavonoidSearch最大スコア MS2: -, MS3: -

安定同位体ラベル実験で見積もられた原子数:

N: 0

S: 0

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
C20H30O10	430.18390	0.640	9S-(beta-D-glucopyranosyloxy)-4,10R-dimethyl-2E,4E,6E-dodecene-1,12-dioic acid	LipidMAPS: LMFA01170151
C20H30O10	430.18390	0.640	Phenethyl rutinoside	HMDB: HMDB0032622, HMDB0303058

Level: 2, プリカーサーm/z: 448.21790

Splash: splash10-001i-0000900000-434cc7bdf859769bcbd6

m/z	Int.	NL	Rel.Int.
430.95	1165	17	1000

Level: 3, プリカーサーm/z: 431.03830

Splash: splash10-002e-0159000000-a8b00f701c8fdc95a19d

m/z	Int.	NL	Rel.Int.
345.04	96	86	1000
240.67	79	190	825
326.72	59	104	620
259.08	30	172	318
154.83	26	276	275
412.57	15	18	152
326.11	11	105	116

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(1OH, 1OMe, 1(C-Glu))-B(none)	Flavone	Kaplanin
[Isoflavone]-A(1OH, 1(C-Glu))-B(1OMe)	Isoflavone	Puerarin 4'-methyl ether
[Flavone]-A(1OH, 1OMe, 1(C-Arabinosyl))-B(1OMe)	Flavone	Isomollupentin 7,4'-dimethyl ether
[Flavone]-A(1OH, 1OMe, 1(C-Arabinosyl))-B(1OMe)	Flavone	7,4'-Di-O-Methylisomollupentin
[Flavone]-A(1OH, 1OMe, 1(C-Rhamnosyl))-B(1OH)	Flavone	8-C-Rhamnosylgenkwanin
[Flavone]-A(2OH, 1(3,4-Dihydroxy-6-methyl-5-oxotetrahydro-2-pyranyl))-B(2OH)	Flavone	Derhamnosylmaysin
[Flavone]-A(2OH, 1(6-Deoxy-beta-L-ribo-hexopyranos-3-ulos-1-yl))-B(2OH)	Flavone	6-C-(6-Deoxy-beta-L-ribo-hexopyranos-3-ulos-1-yl)luteolin
[Flavone]-A(2OH, 1(2,6-Dideoxy-beta-L-xylo-hexopyranosyl))-B(1OH, 1OMe)	Flavone	Alternanthin
[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OMe, 1(3-hydroxy-3-methylbutyl))	Flavonol	Aliarin 4'-methyl ether
[Flavonol]-A(1OH, 2OMe)-B(1OMe, 1(4-hydroxy-3-methylbutyl))	Flavonol	3,7-Dihydroxy-2-[3-(4-hydroxy-3-methylbutyl)-4-methoxyphenyl]-5,6-dimethoxy-4H-1-benzopyran-4-one
[Flavonol (3-OMe)]-A(2OMe, 1([@@]-Methylenedioxy))-B(1OMe, 1([@@]-Methylenedioxy))	Flavonol	3,5,8,3'-Tetramethoxy-6,7:4',5'-bis(methylenedioxy)flavone
[Flavan 3-ol]-A(2OH)-B(2OH)-C(1(O-<1,6-Dihydroxy-2-cyclohexene-1-carbonyl>))	Flavan 3-ol	Catechin 3-O-(1,6-dihydroxy-2-cyclohexene-1-carboxylate)