ピーク情報

（なし類）西洋なし生

pos

Peak #1193 MN MID: SE123_S070911_M90

m/z: 313.12796, RT: 36.18, 強度: 2072, ログ強度: -0.12, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 2

DB検索結果: (14 names) Spicatolide C;(-)-Spicatolide C;(Z)-4-Hydroxy-cinnamyl alcohol 4-O-beta-D-glucopyranoside;Triandrin;Nivalenol;Hydroxycoriatin;Isohyenanchin;Anthemolide B;Icariside D3;Deoxyanisatin;Neomajucin;Manglies...

DBごとのヒット数: ALL 12 KG 3 KN 7 HM 2

FlavonoidSearch最大スコア MS2: 0.091, MS3: -

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
C15H20O7	312.12090	-0.719	Spicatolide C	KNApSAcK: C00032178
C15H20O7	312.12090	-0.719	4-Hydroxycinnamyl alcohol 4-D-glucoside	KEGG: C05855 KNApSAcK: C00036358
C15H20O7	312.12090	-0.719	Triandrin	KNApSAcK: C00032379
C15H20O7	312.12090	-0.719	Nivalenol	HMDB: HMDB0004304 KEGG: C06080 KNApSAcK: C00003167
C15H20O7	312.12090	-0.719	Hydroxycoriatin	KNApSAcK: C00021377
C15H20O7	312.12090	-0.719	Icariside D3	KNApSAcK: C00050808
C15H20O7	312.12090	-0.719	Anthemolide B	KNApSAcK: C00033646
C15H20O7	312.12090	-0.719	Deoxyanisatin	KEGG: C12076
C15H20O7	312.12090	-0.719	Neomajucin	KNApSAcK: C00021768
C15H20O7	312.12090	-0.719	Moringyne	HMDB: HMDB0031724
C15H20O7	312.12090	-0.719	3-Hydroxychavicol 1-glucoside	HMDB: HMDB0034861
C15H20O7	312.12090	-0.719	Manglieside A	KNApSAcK: C00030716

MSnスペクトル情報

Level: 2, プリカーサーm/z: 313.12796

Splash: splash10-0002-0090000000-da0cc71c411cb388a9a2

m/z	Int.	NL	Rel.Int.
295.02	585	18	1000
267.08	131	46	224
271.96	54	41	91
223.35	34	90	57

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.091	[Isoflavone]-A(1OMe)-B(2OMe)	Isoflavone	Cabreuvin
0.000	[Flavone]-A(1OMe)-B(2OMe)	Flavone	7,3',4'-Trimethoxyflavone
0.000	[Flavone]-A(1OMe)-B(2OMe)	Flavone	7,2',4'-Trimethoxyflavone
0.000	[Flavone]-A(2OMe)-B(1OMe)	Flavone	5,6,2'-Trimethoxyflavone
0.000	[Flavone]-A(1OMe)-B(2OMe)	Flavone	6,2',3'-Trimethoxyflavone
0.000	[Flavone]-A(2OMe)-B(1OMe)	Flavone	5,6,3'-Trimethoxyflavone
0.000	[Flavone]-A(none)-B(3OMe)	Flavone	3',4',5'-Trimethoxyflavone
0.000	[Flavone]-A(2OMe)-B(1OMe)	Flavone	5,7,2'-Trimethoxyflavone
0.000	[Flavone]-A(2OMe)-B(1OMe)	Flavone	Apigenin 5,7,4'-trimethyl ether
0.000	[Flavone]-A(3OMe)-B(none)	Flavone	Baicalein 5,6,7-trimethyl ether
0.000	[Flavone]-A(3OMe)-B(none)	Flavone	Norwogonin 5,7,8-trimethyl ether
0.000	[Coumestan]-A(1OH)-B(2OMe)	Coumestan	3-Hydroxy-8,9-dimethoxycoumestan
0.000	[Coumestan]-A(1OH)-B(2OMe)	Coumestan	Wairol
0.000	[Chalcone]-A(none)-B(2OH, 1OMe, 1Formyl, 1Methyl)	Chalcone	3-Formyl-4,6-dihydroxy-2-methoxy-5-methylchalcone
0.000	[Chalcone]-A(2OMe)-B(1([@@]-Methylenedioxy))	Chalcone	3,4-Methylenedioxy-2',4'-dimethoxychalcone
0.000	[2'-Hydroxychalcone]-A(2OH, 1OMe, 1Formyl, 1Methyl)-B(none)	2'-Hydroxychalcone	Leridal chalcone
0.000	[Chalcone]-A(2OMe, 1([@@]-Methylenedioxy))-B(none)	Chalcone	Helilandin A
0.000	[beta-Hydroxy(or Oxodihydro)chalcone]-A(1([@@]-Methylenedioxy))-B(1([@@]-Methylenedioxy))	beta-Hydroxy(or Oxodihydro)chalcone	Galiposin
0.000	[UBR-type derivative / 2',6'-Dioxo-3'-enyl-0-hydroxy-type Chalcone]-A(1OMe, 3Methyl)-B(none)	UBR-type derivative / 2',6'-Dioxo-3'-enyl-0-hydroxy-type Chalcone	Desmosdumotin C
0.000	[Flavanone]-A(1OH, 1OMe, 1Formyl, 1Methyl)-B(none)	Flavanone	Leridal
0.000	[Flavanone]-A(1OH, 1OMe, 1Formyl, 1Methyl)-B(none)	Flavanone	Desmosflavanone II
0.000	[Flavone]-A(1OH, 1OMe)-B(1([@@]-Methylenedioxy))	Flavone	Prosogerin A
0.000	[Flavone]-A(1OH, 1OMe)-B(1([@@]-Methylenedioxy))	Flavone	6-Hydroxy-7-methoxy-3',4'-methylenedioxyflavone
0.000	[Flavone]-A(1OH, 1OMe, 2Methyl)-B(1OH)	Flavone	5,2'-Dihydroxy-7-methoxy- 6,8-dimethylflavone
0.000	[Flavone]-A(1OH, 1OMe, 1Methyl)-B(1OMe)	Flavone	8-Demethyleucalyptin
0.000	[Flavone]-A(1OH, 1OMe, 2Methyl)-B(1OH)	Flavone	Sideroxylin
0.000	[Flavone]-A(1OH, 1OMe)-B(1([@@]-Methylenedioxy))	Flavone	5-Hydroxy-7-methoxy-3',4'-methylenedioxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH)-B(1([@@]-Methylenedioxy))	Flavonol	3-Hydroxy-7-methoxy-3',4'-methylenedioxyflavone
0.000	[Flavonol (3-OMe)]-A(2OMe)-B(none)	Flavonol	Galangin 3,5,7-trimethyl ether
0.000	[Flavonol (3-OMe)]-A(2OH, 2Methyl)-B(none)	Flavonol	5,7-Dihydroxy-3-methoxy-6,8-dimethylflavone
0.000	[Flavonol]-A(1OH, 1OMe, 2Methyl)-B(none)	Flavonol	3,5-Dihydroxy-7-methoxy-6,8-dimethylflavone
0.000	[Isoflavone]-A(1OH)-B(1OMe, 1([@@]-Methylenedioxy))	Isoflavone	Cuneatin
0.000	[Isoflavone]-A(1OH, 1OMe)-B(1([@@]-Methylenedioxy))	Isoflavone	Fujikinetin
0.000	[Isoflavone]-A(1OH, 1OMe)-B(1([@@]-Methylenedioxy))	Isoflavone	Maximaisoflavone E
0.000	[Isoflavone]-A(1OH, 1OMe, 1Methyl)-B(1OMe)	Isoflavone	7-Hydroxy-5,4'-dimethoxy-8-methylisoflavone
0.000	[Isoflavone]-A(1OMe, 1([@@]-Methylenedioxy))-B(1OH)	Isoflavone	Betavulgarin
0.000	[Isoflavone]-A(1OH, 1([@@]-Methylenedioxy))-B(1OMe)	Isoflavone	Irisone A
0.000	[Isoflavone]-A(1OMe, 1([@@]-Methylenedioxy))-B(1OH)	Isoflavone	Irisolone
0.000	[UBR-type derivative / [9,10]-Benzoquinonyl-type Pterocarpene]-A(1OMe)-B(1OMe)	UBR-type derivative / [9,10]-Benzoquinonyl-type Pterocarpene	4-Deoxybryaquinone
0.000	[Pterocarpene]-A(1OH, 1OMe)-B(1([@@]-Methylenedioxy))	Pterocarpene	3-Hydroxy-4-methoxy-8,9-methylenedioxypterocarpene
0.000	[Pterocarpene]-A(1OMe)-B(2OMe)	Pterocarpene	Bryacarpene 5
0.000	[6-Hydroxydehydrorotenone]-A(2OH, 1Methyl)-B(none)	6-Hydroxydehydrorotenone	Boeravinone B
0.000	[4-phenylcoumarin]-A(2OMe)-B(1OMe)	4-phenylcoumarin	5,7,4'-Trimethoxy-4-phenylcoumarin
0.000	[CCS-type derivative / [5,2']-Epoxy-4-phenylcoumarin]-A(1OMe)-B(1OH, 1OMe)	CCS-type derivative / [5,2']-Epoxy-4-phenylcoumarin	5'-Hydroxy-7,4'-dimethoxy-5,2'-oxido-4-phenylcoumarin

Level: 3, プリカーサーm/z: 295.06171

Splash: splash10-014i-0090000000-45a3217e0c1f5ac71927

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Auronol (2-OMe)]-A(1([2,3:@@]-Furano))-B(none)	Auronol	Castillene A
[beta-Hydroxy(or Oxodihydro)chalcone]-A(1OMe, 1Oxo, 1([2,3:@@]-Furano))-B(none)	beta-Hydroxy(or Oxodihydro)chalcone	Pongamol
[Flavanone]-A(1OMe, 1([2,3:@@]-Furano))-B(none)	Flavanone	6-Methoxy-[2'',3'':7,8]furanoflavanone
[Dihydroflavonol (3-OMe)]-A(1([2,3:@@]-Furano))-B(none)	Dihydroflavonol	3-Methoxy-[2'',3'':7,8]furanoflavanone
[2-substituted Isoflavone (2-Methyl)]-A(1OH, 1Acetyl)-B(none)	2-substituted Isoflavone	Glyzarin
[Pterocarpan]-A(1([2,3:@@]-Furano))-B(1OMe)	Pterocarpan	9-O-Methylneodunol

m/z	Int.	NL	Rel.Int.
267.07	243	28	1000
277.11	32	18	133

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	FS2	FS3	共有数
1193	36.18	313.12796	0.0000	-0.12	[M+H]+	(14 names) Spicatolide C; (-)-Spicatolide C; (Z)-4-Hydroxy-cinnamyl alcohol 4-O-beta-D-glucopyranoside; Triandrin; Nivalenol; Hydroxycoriatin; Isohyenanchin; Anthemolide B; Icariside D3; Deoxyanisatin; Neomajucin; Manglies...	ALL 12 KG 3 KN 7 HM 2	MS2 MS3	0.091		2
	36.19	295.11771	-18.0102	-0.37	[M-H2O+H]+	(14 names) Spicatolide C; (-)-Spicatolide C; (Z)-4-Hydroxy-cinnamyl alcohol 4-O-beta-D-glucopyranoside; Triandrin; Nivalenol; Hydroxycoriatin; Isohyenanchin; Anthemolide B; Icariside D3; Deoxyanisatin; Neomajucin; Manglies...	ALL 12 KG 3 KN 7 HM 2	MS2			2

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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