ピーク情報

そばそば粉全層粉

pos

Peak #5716 MN MID: SE120_S011221_M90

m/z: 325.27380, RT: 99.74, 強度: 6548, ログ強度: 0.43, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 6

DB検索結果: (21 names) 14-hydroxy-11Z,17Z-eicosadienoic acid;13Z-Labdene-8alpha,15,16-triol;11,12-epoxy-14Z-Eicosenoic acid;15R-hydroxy-11Z-13E-eicosadienoic acid;14,15-Epoxyeicosa-5z-enoic acid;2beta,8beta,15-Trihydroxy-en...

DBごとのヒット数: ALL 19 KN 11 HM 2 LM 6

FlavonoidSearch最大スコア MS2: 0.143, MS3: 0.200

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
C20H36O3	324.26645	0.250	14-hydroxy-11Z,17Z-eicosadienoic acid	LipidMAPS: LMFA01050431
C20H36O3	324.26645	0.250	13Z-Labdene-8alpha,15,16-triol	KNApSAcK: C00023336
C20H36O3	324.26645	0.250	11,12-epoxy-14Z-Eicosenoic acid	LipidMAPS: LMFA01070024
C20H36O3	324.26645	0.250	15R-hydroxy-11Z-13E-eicosadienoic acid	LipidMAPS: LMFA03000008
C20H36O3	324.26645	0.250	14,15-Epoxyeicosa-5z-enoic acid	HMDB: HMDB0244590
C20H36O3	324.26645	0.250	Vitexifolin B	KNApSAcK: C00045445
C20H36O3	324.26645	0.250	2beta,8beta,15-Trihydroxy-ent-labd-13E-one	KNApSAcK: C00023415
C20H36O3	324.26645	0.250	14,15-Dihydro-14,15-dihydroxygeranyllinalol	KNApSAcK: C00022112
C20H36O3	324.26645	0.250	11R-hydroxy-12E,14Z-eicosadienoic acid	LipidMAPS: LMFA03000005, LMFA03000009
C20H36O3	324.26645	0.250	Moponeol A	KNApSAcK: C00044939, C00044940
C20H36O3	324.26645	0.250	(Z)-15-Oxo-11-eicosenoic acid	HMDB: HMDB0029797
C20H36O3	324.26645	0.250	Crolechinol	KNApSAcK: C00035569
C20H36O3	324.26645	0.250	Trixagotriol	KNApSAcK: C00022206
C20H36O3	324.26645	0.250	8-Labdene-13R,14R,15-triol	HMDB: HMDB0034957 KNApSAcK: C00023332
C20H36O3	324.26645	0.250	14S,15R-epoxy-11Z-eicosenoic acid	LipidMAPS: LMFA01070021
C20H36O3	324.26645	0.250	20-hydroxy-6Z,15Z-eicosadienoic acid	HMDB: HMDB0245564 LipidMAPS: LMFA03000010
C20H36O3	324.26645	0.250	13E-Labdene-3beta,8alpha,15-triol	KNApSAcK: C00023334
C20H36O3	324.26645	0.250	7-Labdene-13R,14R,15-triol	HMDB: HMDB0034958 KNApSAcK: C00023328
C20H36O3	324.26645	0.250	Barbatol	KNApSAcK: C00022300

MSnスペクトル情報

Level: 2, プリカーサーm/z: 325.27368

Splash: splash10-0a4i-0009000000-0d72c0c39fadd472fb8f

m/z	Int.	NL	Rel.Int.
307.24	6766	18	1000
269.11	518	56	76

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.143	[Flavanone]-A(2OH, 1(C-Prenyl))-B(none)	Flavanone	Glabranin
0.143	[Flavanone]-A(2OH, 1(C-Prenyl))-B(none)	Flavanone	5,7-Dihydroxy-6-C-prenylflavanone
0.143	[Flavanone]-A(1OH, 1(C-Prenyl))-B(1OH)	Flavanone	Crotaramosmin
0.143	[2'-Hydroxychalcone]-A(3OH, 1(C-Prenyl))-B(none)	2'-Hydroxychalcone	Desmethylisoxanthohumol
0.118	[Flavanone]-A(1OH, 1(C-Prenyl))-B(1OH)	Flavanone	Isobavachin
0.118	[Flavanone]-A(1OH, 1(C-Prenyl))-B(1OH)	Flavanone	Bavachin
0.118	[Flavanone]-A(1OH)-B(1OH, 1(C-Prenyl))	Flavanone	Abyssinone II
0.118	[2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl))-B(1OH)	2'-Hydroxychalcone	Isobavachalcone
0.118	[2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl))-B(1OH)	2'-Hydroxychalcone	Broussochalcone B
0.118	[2'-Hydroxychalcone]-A(2OH)-B(1OH, 1(C-Prenyl))	2'-Hydroxychalcone	Licoagrochalcone A
0.083	[Pterocarpan]-A(1OH, 1(C-Prenyl))-B(1OH)	Pterocarpan	2-Prenyldemethylmedicarpin
0.083	[Pterocarpan]-A(1OH)-B(1OH, 1(C-Prenyl))	Pterocarpan	8-Prenyldemethylmedicarpin
0.083	[Pterocarpan]-A(1OH)-B(1OH, 1(C-Prenyl))	Pterocarpan	Phaseollidin
0.000	[Chalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyldihydropyrano)))-B(1OH)	Chalcone	Crotmadine
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))-B(none)	2'-Hydroxychalcone	Flemistrictin E
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))-B(none)	2'-Hydroxychalcone	Flemistrictin B
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))-B(none)	2'-Hydroxychalcone	Flemistrictin F
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))-B(none)	2'-Hydroxychalcone	Flemistrictin C
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyldihydropyrano)))-B(1OH)	2'-Hydroxychalcone	Dorsmanin A
0.000	[Dihydrochalcone]-A(2OH, 1([2,3:@@]-(6-Methyl-4,7-dihydrooxepino)))-B(none)	Dihydrochalcone	1-(2,5-dihydro-6,8-dihydroxy-3-methyl-1-benzoxepin-7-yl)-3-phenyl-1-propanone
0.000	[Flavanone]-A(1OH, 1(3-Hydroxy-3-methyl-1-butenyl))-B(none)	Flavanone	7-Hydroxy-8-C-(3-hydroxy-3-methyl-trans-buten-1-yl)flavanone
0.000	[Flavanone]-A(2OMe, 1([2,3:@@]-Furano))-B(none)	Flavanone	5,6-Dimethoxy-[2'',3'':7,8]furanoflavanone
0.000	[Isoflavanone]-A(1([2,3:@@]-Furano))-B(2OMe)	Isoflavanone	Neoraunone
0.000	[Isoflavan]-A(1OH)-B(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))	Isoflavan	Crotmarine
0.000	[Isoflavan]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	Isoflavan	Glabridin
0.000	[Isoflavan]-A(1OH)-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Isoflavan	Phaseollinisoflavan
0.000	[Pterocarpan]-A(1([2,3:@@]-Furano))-B(2OMe)	Pterocarpan	Ambonane
0.000	[Pterocarpan-6a-ol]-A(1([2,3:@@]-Furano))-B(1([@@]-Methylenedioxy))	Pterocarpan-6a-ol	Neobanol

Level: 3, プリカーサーm/z: 307.23593

Splash: splash10-000i-1890000000-0fa353a26651c8908365

m/z	Int.	NL	Rel.Int.
289.27	707	18	1000
193.15	160	114	226
271.24	155	36	219
94.98	146	212	205
136.97	126	170	177
187.04	103	120	146
175.00	101	132	143
108.92	97	198	137
122.99	95	184	134
223.19	88	84	124
191.11	82	116	116
150.86	79	156	111
165.16	75	142	105
251.17	74	56	105
189.06	71	118	100
209.16	70	98	99
207.24	59	100	83
201.19	51	106	72
179.17	49	128	69
120.99	48	186	68

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.065	[Flavanone]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	Flavanone	Isolonchocarpin
0.065	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	2'-Hydroxychalcone	Lonchocarpin
0.042	[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

Level: 3, プリカーサーm/z: 269.11429

Splash: splash10-03di-0090000000-6684453cde9dd6646c63

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.200	[Flavone]-A(1OMe)-B(1OH)	Flavone	Isopratol
0.200	[Flavone]-A(1OH, 1OMe)-B(none)	Flavone	Trigraecum
0.200	[Flavone]-A(1OH)-B(1OMe)	Flavone	5-Hydroxy-2'-methoxyflavone
0.200	[Flavone]-A(1OH, 1OMe)-B(none)	Flavone	5-Hydroxy-6-methoxyflavone
0.200	[Flavone]-A(1OH)-B(1OMe)	Flavone	6-Hydroxy-4'-methoxyflavone
0.200	[Flavone]-A(1OH, 1OMe)-B(none)	Flavone	Tectochrysin
0.167	[Coumestan]-A(1OH)-B(1OH)	Coumestan	Coumestrol
0.063	[Flavonol]-A(none)-B(1OMe)	Flavonol	3-Hydroxy-4'-methoxyflavone
0.053	[Isoflavone]-A(1OH)-B(1OMe)	Isoflavone	Formononetin
0.053	[Isoflavone]-A(1OH)-B(1OMe)	Isoflavone	Pallidiflorin
0.053	[Isoflavone]-A(1OMe)-B(1OH)	Isoflavone	Isoformononetin
0.053	[Isoflavone]-A(1OH, 1OMe)-B(none)	Isoflavone	5-Hydroxy-7-methoxyisoflavone
0.000	[Aurone]-A(1OH, 1Methyl)-B(1OH)	Aurone	6,4'-Dihydroxy-7-methylaurone
0.000	[Flavanone]-A(1OH, 2Methyl)-B(none)	Flavanone	7-Hydroxy-6,8-di-C-methylflavanone
0.000	[Flavone]-A(2OH, 1Methyl)-B(none)	Flavone	Strobochrysin
0.000	[4-phenylcoumarin]-A(1OH, 1OMe)-B(none)	4-phenylcoumarin	Dalbergin
0.000	[4-phenylcoumarin]-A(1OH, 1OMe)-B(none)	4-phenylcoumarin	Isodalbergin