ピーク情報

パセリ　根

pos

Peak #2796 MN MID: SE61_S24_M90

m/z: 451.17823, RT: 31.11, 強度: 9713, ログ強度: 0.49, アダクト: [M+Na]+, 共有数（同様のピークを含むサンプル数）: 3

DB検索結果: Pyridinoline

DBごとのヒット数: ALL 1 HM 1

FlavonoidSearch最大スコア MS2: -, MS3: 0.083

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
C18H28O8N4	428.19071	-3.986	Pyridinoline	HMDB: HMDB0000851

MSnスペクトル情報

Level: 2, プリカーサーm/z: 451.17844

Splash: splash10-014i-0009000000-906d45ecf51a4ae300da

m/z	Int.	NL	Rel.Int.
319.20	4631	132	1000
320.25	427	131	92
317.11	349	134	75
361.38	332	90	71

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavanone]-A(2OH, 1(C-Glu))-B(2OH)	Flavanone	8-C-Glucopyranosyleriodictylol
[Flavanone]-A(2OH, 1(C-Glu))-B(2OH)	Flavanone	5,7,3',4'-Tetrahydroxyflavanone 6-C-glucoside
[Flavone]-A(1OMe, 1([5,4:@@]-(2,2-Dimethyldihydro-3a-acetoxy-3-oxofuro[2,3-c]pyrano)))-B(none)	Flavone	Tephrodin
[CCS-type derivative / [2',3]-Prenyloxidoflavone]-A(2OH, 1(C-Prenyl))-B(1OH, 1OMe)	CCS-type derivative / [2',3]-Prenyloxidoflavone	Dihydrocycloartomunin
[CCS-type derivative / [2',3]-Prenyloxidoflavone]-A(1OH, 1OMe, 1(C-Prenyl))-B(2OH)	CCS-type derivative / [2',3]-Prenyloxidoflavone	Cycloaltilisin
[CCS-type derivative / [2',3]-Prenyloxidoflavone]-A(2OH, 1(C-Prenyl))-B(1OH, 1OMe)	CCS-type derivative / [2',3]-Prenyloxidoflavone	Dihydroisocycloartomunin
[CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone]-A(1OH, 1OMe)-B(2OH, 1(C-Prenyl))	CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone	Artonin T
[Dihydroflavonol]-A(2OH, 1(C-Glu))-B(1OH)	Dihydroflavonol	6-C-Glucosylaromadendrin
[Dihydroflavonol]-A(2OH, 1(C-Glu))-B(1OH)	Dihydroflavonol	8-C-Glucosylaromadendrin
[Flavonol (3-OMe)]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	Flavonol	Broussoflavonol A
[Isoflavone]-A(2OH, 2(C-Prenyl))-B(1OH, 1([@@]-Methylenedioxy))	Isoflavone	Euchrenone b5
[Isoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH, 1OMe, 1(C-Prenyl))	Isoflavone	Cajaisoflavone
[Isoflavanone]-A(2OH, 1(C-Glu))-B(2OH)	Isoflavanone	Macrocarposide
[Coumaranochromon]-A(2OH, 1(C-Prenyl))-B(1OH, 1OMe, 1(C-Prenyl))	Coumaranochromon	8-Prenyllisetin

Level: 3, プリカーサーm/z: 319.16913

Splash: splash10-0a4i-0900000000-9a470f36987f936a4294

m/z	Int.	NL	Rel.Int.
157.07	198	162	1000
184.86	18	134	92

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.083	[Flavone]-A(4OH)-B(2OH)	Flavone	Bitalgenin
0.053	[Flavonol]-A(4OH)-B(1OH)	Flavonol	3,5,6,7,8,4'-Hexahydroxyflavone
0.000	[Flavone]-A(3OH)-B(3OH)	Flavone	5,6,7,3',4',5'-Hexahydroxyflavone
0.000	[Flavone]-A(3OH)-B(3OH)	Flavone	5,7,8,3',4',5'-Hexahydroxyflavone
0.000	[Dihydroflavonol (3-OMe)]-A(2OH)-B(2OH)	Dihydroflavonol	Taxifolin 3-methyl ether
0.000	[Anthocyanidin]-A(3OH)-B(3OH)	Anthocyanidin	6-Hydroxydelphinidin
0.000	[Dihydroflavonol]-A(2OH, 1OMe)-B(1OH)	Dihydroflavonol	3,5,7,4'-Tetrahydroxy-6-methoxyflavanone
0.000	[Dihydroflavonol]-A(2OH)-B(1OH, 1OMe)	Dihydroflavonol	Dihydroisorhamnetin
0.000	[Dihydroflavonol]-A(2OH, 1OMe)-B(1OH)	Dihydroflavonol	3,5,7,4'-Tetrahydroxy-8-methoxyflavanone
0.000	[Dihydroflavonol]-A(1OH, 1OMe)-B(2OH)	Dihydroflavonol	8-Methoxyfustin
0.000	[Dihydroflavonol]-A(1OH, 1OMe)-B(2OH)	Dihydroflavonol	3,5,2',3'-Tetrahydroxy-7-methoxyflavanone
0.000	[Dihydroflavonol]-A(1OH, 1OMe)-B(2OH)	Dihydroflavonol	Taxifolin 5-methyl ether
0.000	[Dihydroflavonol]-A(1OH, 1OMe)-B(2OH)	Dihydroflavonol	Padmatin
0.000	[Dihydroflavonol]-A(2OH)-B(1OH, 1OMe)	Dihydroflavonol	3,5,7,2'-Tetrahydroxy-5'-methoxyflavanone
0.000	[Dihydroflavonol]-A(2OH)-B(1OH, 1OMe)	Dihydroflavonol	Taxifolin 4'-methyl ether
0.000	[Dihydroflavonol]-A(1OH)-B(2OH, 1OMe)	Dihydroflavonol	Sepinol
0.000	[Flavanone]-A(3OH)-B(1OH, 1OMe)	Flavanone	8-Hydroxyhesperetin
0.000	[Flavanone]-A(2OH, 1OMe)-B(2OH)	Flavanone	5,7,2',5'-Tetrahydroxy-6-methoxyflavanone
0.000	[Flavanone]-A(2OH, 1OMe)-B(2OH)	Flavanone	6-Methoxyeriodictyol
0.000	[Flavanone]-A(2OH, 1OMe)-B(2OH)	Flavanone	8-Methoxyeriodictyol
0.000	[Isoflavan]-A(2OH)-B(1OH, 2OMe)	Isoflavan	Bryaflavan
0.000	[Isoflavan]-A(2OH)-B(1OH, 2OMe)	Isoflavan	8-Demethylduartin
0.000	[Flavan 3-ol]-A(1OH, 1OMe)-B(1OH, 1OMe)	Flavan 3-ol	Catechin 5,3'-dimethyl ether
0.000	[Flavan 3-ol]-A(1OH, 1OMe)-B(1OH, 1OMe)	Flavan 3-ol	Catechin 7,4'-dimethyl ether
0.000	[Flavan 3-ol]-A(2OH)-B(2OMe)	Flavan 3-ol	Catechin 3',4'-dimethyl ether
0.000	[Flavonol]-A(3OH)-B(2OH)	Flavonol	Quercetagetin
0.000	[Flavonol]-A(3OH)-B(2OH)	Flavonol	Gossypetin
0.000	[Flavonol]-A(2OH)-B(3OH)	Flavonol	3,5,8,3',4',5'-Hexahydroxyflavone
0.000	[Flavonol]-A(2OH)-B(3OH)	Flavonol	Myricetin
0.000	[Flavonol]-A(2OH)-B(3OH)	Flavonol	5'-Hydroxymorin
0.000	[Flavonol]-A(2OH)-B(3OH)	Flavonol	3,5,7,2',3',4'-Hexahydroxyflavone
0.000	[UBR-type derivative / 4'-Oxocyclohexa-2'-enyl-type Flavanone]-A(2OH, 2Methyl)-B(1OH)	UBR-type derivative / 4'-Oxocyclohexa-2'-enyl-type Flavanone	Protofarrerol
0.000	[Dihydroflavonol]-A(2OH, 1Methyl)-B(2OH)	Dihydroflavonol	6-Methyltaxifolin
0.000	[Dihydroflavonol]-A(2OH, 1Methyl)-B(2OH)	Dihydroflavonol	Deodarin
0.000	[Flavan 4-ol]-A(2OH, 1Hydroxymethyl, 1Methyl)-B(1OH)	Flavan 4-ol	4,5,7,4'-Tetrahydroxy-6-hydroxymethyl-8-methylflavan
0.000	[Isoflavanone-3-ol]-A(2OH)-B(1OH, 1OMe)	Isoflavanone-3-ol	Bolusanthin
0.000	[3-substituted 2-Phenylbenzofuran (3-COOH)]-A(2OH)-B(3OH)	3-substituted 2-Phenylbenzofuran	Norwedelic acid

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	FS3	共有数
	31.07	474.25404	23.0758	0.75	[M+C2H7N+H]+	Pyridinoline	ALL 1 HM 1	MS2 MS3		3
	31.11	467.15213	15.9739	0.34	[M+K]+	Pyridinoline	ALL 1 HM 1			4
2796	31.11	451.17823	0.0000	0.49	[M+Na]+	Pyridinoline	ALL 1 HM 1	MS2 MS3	0.083	3
	31.10	446.22279	-4.9554	0.63	[M+NH4]+	Pyridinoline	ALL 1 HM 1	MS2 MS3		4
	31.07	429.19634	-21.9819	-0.02	[M+H]+	Pyridinoline	ALL 1 HM 1			4

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

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