ピーク情報

ポプラ, 幼植物, 地上部

pos

Peak #7276 MN MID: SE205_S08_M90

m/z: 305.10205, RT: 61.78, 強度: 1819, ログ強度: -0.34, 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: (44 names) 2-(3,4-Dihydroxyphenyl)-2-methyl-3,4-dihydrochromene-3,5,7-triol;3-Methyl-epicatechin;(S)-Hemiketal;Phebaclavin B;(-)-3-[2-(Acetyloxy)propyl]-2-hydroxy-8-methoxy-1,4-naphthoquinone;(3R)-7,8,2',3'-Tetr...

DBごとのヒット数: ALL 38 KG 7 KN 25 HM 5 LM 1

FlavonoidSearch最大スコア MS2: 0.750, MS3: -

DB検索結果

ppm

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
C16H16O6	304.09469	0.272	2-(3,4-Dihydroxyphenyl)-2-methyl-3,4-dihydrochromene-3,5,7-triol	HMDB: HMDB0257999
C16H16O6	304.09469	0.272	3-Methyl-epicatechin	HMDB: HMDB0029231
C16H16O6	304.09469	0.272	(S)-Hemiketal	KEGG: C18356
C16H16O6	304.09469	0.272	(-)-3-[2-(Acetyloxy)propyl]-2-hydroxy-8-methoxy-1,4-naphthoquinone	KNApSAcK: C00029274
C16H16O6	304.09469	0.272	Phebaclavin B	KNApSAcK: C00045363
C16H16O6	304.09469	0.272	(S)-Chiral alcohol	KEGG: C18354
C16H16O6	304.09469	0.272	Griseophenone C	KEGG: C18836
C16H16O6	304.09469	0.272	Fonsecin B	HMDB: HMDB0033866 KNApSAcK: C00034518
C16H16O6	304.09469	0.272	Heraclenol	HMDB: HMDB0030745 KNApSAcK: C00037262
C16H16O6	304.09469	0.272	3'-O-Methylcatechin	HMDB: HMDB0041507, HMDB0245959
C16H16O6	304.09469	0.272	Photinide A	KNApSAcK: C00048057, C00048058
C16H16O6	304.09469	0.272	(R)-7-Methoxy-6,8-dihydroxy-alpha-dunnione	KNApSAcK: C00042017
C16H16O6	304.09469	0.272	Episappanol	KNApSAcK: C00020451
C16H16O6	304.09469	0.272	Ventiloquinone I	KNApSAcK: C00046496
C16H16O6	304.09469	0.272	6-Methoxy-alpha-pyrufuran	HMDB: HMDB0041294 KEGG: C08761 KNApSAcK: C00002401
C16H16O6	304.09469	0.272	Dihydrokalafungin dihydroquinone form	KEGG: C18360
C16H16O6	304.09469	0.272	Oxypeucedanin hydrate	HMDB: HMDB0256020 KNApSAcK: C00030905, C00035717
C16H16O6	304.09469	0.272	Altersolanol B	KNApSAcK: C00017975
C16H16O6	304.09469	0.272	Herbarin	KNApSAcK: C00018803
C16H16O6	304.09469	0.272	Glochidiolide	KNApSAcK: C00031821, C00031904
C16H16O6	304.09469	0.272	Protosappanin B	HMDB: HMDB0256875
C16H16O6	304.09469	0.272	beta-Cotonefuran	KEGG: C08740 KNApSAcK: C00002394
C16H16O6	304.09469	0.272	8-O-Methyljavanicin	KNApSAcK: C00023708
C16H16O6	304.09469	0.272	4-Methyl-epicatechin	HMDB: HMDB0029228
C16H16O6	304.09469	0.272	Wentilactone A	KNApSAcK: C00023389, C00023905
C16H16O6	304.09469	0.272	Phebaclavin A	KNApSAcK: C00045362
C16H16O6	304.09469	0.272	4,2',4',beta-Tetrahydroxy-6'-methoxydihydrochalcone	KNApSAcK: C00014610
C16H16O6	304.09469	0.272	(1S,3S)-Austrocortilutein	KNApSAcK: C00036337
C16H16O6	304.09469	0.272	Penicillenone	KNApSAcK: C00034102
C16H16O6	304.09469	0.272	6-Methoxy-3',4'-dehydromurranganon	KNApSAcK: C00019948
C16H16O6	304.09469	0.272	(3R)-3',8-Dihydroxyvestitol	FlavonoidViewer: FLIC3LNS0004 KNApSAcK: C00010032 LipidMAPS: LMPK12080042
C16H16O6	304.09469	0.272	Symplocosidin	FlavonoidViewer: FL63ADNS0001, FL63CDNS0001 HMDB: HMDB0029175, HMDB0038519 KNApSAcK: C00008809, C00013259, C00055676 LipidMAPS: LMPK12020111, LMPK12020142
C16H16O6	304.09469	0.272	4,2',4',beta-Tetrahydroxy-6'-methoxy-alpha,beta-dihydrochalcone	FlavonoidViewer: FL1DHYNS0005 LipidMAPS: LMPK12120590
C16H16O6	304.09469	0.272	Catechin-7-methyl ether	FlavonoidViewer: FL63CCNS0001 KNApSAcK: C00013258 LipidMAPS: LMPK12020141
C16H16O6	304.09469	0.272	Ortin-4alpha-ol 8-methyl ether	FlavonoidViewer: FL6D3ANS0004, FL6D3ANS0005 KNApSAcK: C00009007, C00009008 LipidMAPS: LMPK12020189, LMPK12020190
C16H16O6	304.09469	0.272	3,4,4',alpha-Tetrahydroxy-2'-methoxydihydrochalcone	FlavonoidViewer: FL1DHXNS0006 KNApSAcK: C00007950 LipidMAPS: LMPK12120578
C16H16O6	304.09469	0.272	Catechin 4'-methyl ether	FlavonoidViewer: FL63AENS0001 HMDB: HMDB0029179, HMDB0030662 KNApSAcK: C00008810 LipidMAPS: LMPK12020113
C10H22O4N2Cl2	304.09566	-2.935	Mannomustine dihydrochloride	KEGG: [f]C19441

MSnスペクトル情報

Level: 2, プリカーサーm/z: 305.10196

Splash: splash10-004i-0900000000-b60d3afa7b49ec1890bb

m/z	Int.	NL	Rel.Int.
178.94	6795	126	1000
137.00	522	168	76
287.16	361	18	53

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.750	[Dihydroflavonol]-A(1OH)-B(3OH)	Dihydroflavonol	Dihydrorobinetin
0.600	[Flavan 3-ol]-A(2OH)-B(1OH, 1OMe)	Flavan 3-ol	Symplocosidin
0.600	[Flavan 3-ol]-A(2OH)-B(1OH, 1OMe)	Flavan 3-ol	Catechin 4'-methyl ether
0.600	[Flavan 3-ol]-A(2OH)-B(1OH, 1OMe)	Flavan 3-ol	Catechin-3'-methyl ether
0.333	[2'-Hydroxychalcone]-A(3OH)-B(3OH)	2'-Hydroxychalcone	3,4,5,2',4',6'-Hexahydroxychalcone
0.300	[Flavanone]-A(2OH)-B(3OH)	Flavanone	5,7,3',4',5'-Pentahydroxyflavanone
0.167	[Dihydroflavonol]-A(3OH)-B(1OH)	Dihydroflavonol	3,5,7,8,4'-Pentahydroxyflavanone
0.167	[Dihydroflavonol]-A(2OH)-B(2OH)	Dihydroflavonol	8-Hydroxyfustin
0.167	[Dihydroflavonol]-A(2OH)-B(2OH)	Dihydroflavonol	3,5,7,2',5'-Pentahydroxyflavanone
0.167	[Dihydroflavonol]-A(2OH)-B(2OH)	Dihydroflavonol	3,5,7,2',6'-Pentahydroxyflavanone
0.143	[Isoflavan]-A(2OH)-B(2OH, 1OMe)	Isoflavan	3',8-Dihydroxyvestitol
0.143	[Flavan 3-ol]-A(1OH, 1OMe)-B(2OH)	Flavan 3-ol	Catechin-7-methyl ether
0.111	[Dihydroflavonol]-A(2OH)-B(2OH)	Dihydroflavonol	Taxifolin
0.111	[Dihydroflavonol]-A(2OH)-B(2OH)	Dihydroflavonol	Dihydromorin
0.100	[Dihydroflavonol]-A(2OH)-B(2OH)	Dihydroflavonol	3,5,7,3',5'-Pentahydroxyflavanone
0.077	[Flavone]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	Flavone	6'',6''-Dimethylpyrano[2'',3'':7,8]flavone
0.000	[Auronol]-A(2OH)-B(2OH)	Auronol	Nigrescin
0.000	[Auronol]-A(2OH)-B(2OH)	Auronol	Alphitonin
0.000	[beta-Hydroxy(or Oxodihydro)chalcone]-A(3OH)-B(2OH)	beta-Hydroxy(or Oxodihydro)chalcone	3,4,2',4',6',beta-Hexahydroxychalcone
0.000	[Dihydrochalcone alpha-ol]-A(1OH, 1OMe)-B(2OH)	Dihydrochalcone alpha-ol	3,4,4',alpha-Tetrahydroxy-2'-methoxydihydrochalcone
0.000	[Dihydrochalcone beta-ol]-A(2OH, 1OMe)-B(1OH)	Dihydrochalcone beta-ol	4,2',4',beta-Tetrahydroxy-6'-methoxydihydrochalcone
0.000	[2-Hydroxyflavanone]-A(2OH)-B(2OH)	2-Hydroxyflavanone	2,5,7,3',4'-Pentahydroxyflavanone
0.000	[Flavone]-A(2OH, 1Cl)-B(1OH)	Flavone	6-Chloroapigenin
0.000	[Flavan 3,4-diol]-A(1OH, 1OMe)-B(1OH)	Flavan 3,4-diol	Ortin-4alpha-ol 8-methyl ether

Level: 3, プリカーサーm/z: 178.91064

Splash: splash10-000i-0900000000-874ded8880014636ff3e

m/z	Int.	NL	Rel.Int.
136.91	1832	42	1000

Level: 3, プリカーサーm/z: 136.96848

Splash: splash10-00di-0900000000-fe96dd6f66e1ed39d5cb