ピーク情報

リーフレタスグリーン

pos

Peak #9963 MN MID: SE198_S12_M90

m/z: 565.17059, RT: 55.85, 強度: 2224190, ログ強度: 2.85, 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: (3 names) Crenatoside;Protoaphin aglucone;Protoaphin aglycone

DBごとのヒット数: ALL 2 KG 1 KN 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
C30H28O11	564.16316	0.275	Crenatoside	KNApSAcK: C00050565
C30H28O11	564.16316	0.275	Protoaphin aglucone	KEGG: C02879

Level: 2, プリカーサーm/z: 565.17041

Splash: splash10-03di-0030910000-a1389bfcec54cacd5c91

m/z	Int.	NL	Rel.Int.
413.12	33317	152	1000
547.19	5678	18	170
261.05	3396	304	101
287.13	3161	278	94
243.08	2653	322	79
215.04	2437	350	73

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(2OH, 1(C-Glu), 1(C-Xylosyl))-B(1OH)	Flavone	Vicenin 1
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(1OH)	Flavone	Schaftoside
[Flavone]-A(2OH, 1(C-Galactosyl), 1(C-Xylosyl))-B(1OH)	Flavone	Isocorymboside
[Flavone]-A(2OH, 1(C-Arabinosyl), 1(C-Galactosyl))-B(1OH)	Flavone	Neocorymboside
[Flavone]-A(2OH, 1(C-Galactosyl), 1(C-Xylosyl))-B(1OH)	Flavone	6-C-Xylopyranosyl-8-C-galactopyranosylapigenin
[Flavone]-A(2OH, 1(C-Galactosyl), 1(C-Xylosyl))-B(1OH)	Flavone	6-C-Galactopyranosyl-8-C-xylopyranosylapigenin
[Flavone]-A(2OH, 1(C-Glu), 1(C-Xylosyl))-B(1OH)	Flavone	Vicenin 3
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(1OH)	Flavone	Isoschaftoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(1OH)	Flavone	Neoschaftoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(1OH)	Flavone	Neoisoschaftoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Apiofuranosyl))-B(1OH)	Flavone	6-C-beta-D-Glucopyranosyl-8-C-beta-D-apiofuranosylapigenin
[Flavone]-A(2OH, 1(C-Arabinosyl), 1(C-Galactosyl))-B(1OH)	Flavone	Corymboside

Level: 3, プリカーサーm/z: 413.18268

Splash: splash10-004i-0690000000-4f7c8c7aa625a1c2bd87

m/z	Int.	NL	Rel.Int.
126.97	1033	286	1000
279.11	360	134	348
261.07	349	152	338
242.98	344	170	333
215.06	331	198	320
213.14	110	200	106
187.08	104	226	100
237.20	85	176	82
178.82	82	234	79
219.06	80	194	77
269.07	66	144	64
232.81	57	180	55
159.01	53	254	51
395.13	52	18	50

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavonol (3-OMe)]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH, 1OMe)	Flavonol	5,4'-Dihydroxy-3,7,3'-trimethoxy-8-prenylflavone
[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OMe, 1(C-Prenyl))	Flavonol	Viscosol
[4-substituted Flavan 3-ol (4-(2,3,4-Trihydroxyphenyl))]-A(1OH)-B(2OH)	4-substituted Flavan 3-ol	4beta-(2,4-Dihydroxy-3-methoxyphenyl)fisetinidol
[Rotenone]-A(1([2,3:@@]-(5-(2-Hydroxy-1-methylethyl)dihydrofurano)))-B(2OMe)	Rotenone	Dihydroamorphigenin
[Rotenone]-A(1([2,3:@@]-(5-(Hydroxyisopropanyl)dihydrofurano)))-B(2OMe)	Rotenone	Dalpanol
[12a-Hydroxyrotenone]-A(1OH, 1(C-Prenyl))-B(2OMe)	12a-Hydroxyrotenone	12a-Hydroxyrot-2'-enonic acid

Level: 3, プリカーサーm/z: 547.12152

Splash: splash10-014i-0494200000-18741519f43bca38ad95

m/z	Int.	NL	Rel.Int.
215.09	183	332	1000
185.05	75	362	412
371.31	74	176	403
213.14	66	334	363
413.18	49	134	268
366.94	47	180	254
365.29	41	182	225
187.09	41	360	223
429.34	40	118	217
219.20	37	328	204
269.17	34	278	185
257.06	34	290	184
321.31	32	226	173
169.19	26	378	142
483.41	26	64	140
178.99	26	368	139
253.02	24	294	133
243.22	24	304	132
173.20	23	374	128
359.30	19	188	104