ピーク情報

ヒメツリガネゴケ　原糸体（プロトネマ）

pos

Peak #1512 MN MID: SE205_S03_M90

m/z: 299.07591, RT: 35.02, 強度: 35283, ログ強度: 1.19, 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: (4 names) Benzoyl glucuronide (Benzoic acid);D-Prephenyllactate;Demethoxybergenin;(-)-Demethoxybergenin

DBごとのヒット数: ALL 3 KG 1 KN 1 HM 1

FlavonoidSearch最大スコア MS2: 0.050, 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
C13H14O8	298.06887	-0.790	Benzoyl glucuronide (Benzoic acid)	HMDB: HMDB0010324
C13H14O8	298.06887	-0.790	D-Prephenyllactate	KEGG: C00994
C13H14O8	298.06887	-0.790	Demethoxybergenin	KNApSAcK: C00032892

MSnスペクトル情報

Level: 2, プリカーサーm/z: 299.07544

Splash: splash10-03di-0900000000-cc91e2e0aa57e61aef72

m/z	Int.	NL	Rel.Int.
162.95	74597	136	1000

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.050	[Isoflavone]-A(1OH)-B(2OMe)	Isoflavone	Cladrin
0.000	[Flavone]-A(1OH)-B(2OMe)	Flavone	7-Hydroxy-3',4'-dimethoxyflavone
0.000	[Flavone]-A(1OMe)-B(1OH, 1OMe)	Flavone	Tithonine
0.000	[Flavone]-A(1OH, 1OMe)-B(1OMe)	Flavone	5-Hydroxy-6,2'-dimethoxyflavone
0.000	[Flavone]-A(1OH, 1OMe)-B(1OMe)	Flavone	5-Hydroxy-7,2'-dimethoxyflavone
0.000	[Flavone]-A(1OH, 1OMe)-B(1OMe)	Flavone	Apigenin 5,4'-dimethyl ether
0.000	[Flavone]-A(2OMe)-B(1OH)	Flavone	Apigenin 5,7-dimethyl ether
0.000	[Flavone]-A(1OH, 1OMe)-B(1OMe)	Flavone	Apigenin 7,4'-dimethyl ether
0.000	[Flavone]-A(1OH, 2OMe)-B(none)	Flavone	Baicalein 5,6-dimethyl ether
0.000	[Flavone]-A(1OH, 2OMe)-B(none)	Flavone	Mosloflavone
0.000	[Flavone]-A(1OH, 2OMe)-B(none)	Flavone	Norwogonin 5,8-dimethyl ether
0.000	[Flavone]-A(1OH, 2OMe)-B(none)	Flavone	Moslosooflavone
0.000	[Isoflavone]-A(1OH, 1OMe)-B(1OMe)	Isoflavone	Afrormosin
0.000	[Isoflavone]-A(1OH, 1OMe)-B(1OMe)	Isoflavone	Alfalone
0.000	[Isoflavone]-A(1OH, 1OMe)-B(1OMe)	Isoflavone	5-O-Methylbiochanin A
0.000	[Isoflavone]-A(1OMe)-B(1OH, 1OMe)	Isoflavone	Sayanedine
0.000	[Isoflavone]-A(1OH, 1OMe)-B(1OH)	Isoflavone	8-O-Methylretusin
0.000	[Coumestan]-A(1OH)-B(1OH, 1OMe)	Coumestan	8-Methoxycoumestrol
0.000	[Coumestan]-A(1OH)-B(1OH, 1OMe)	Coumestan	Trifoliol
0.000	[Coumestan]-A(1OH, 1OMe)-B(1OH)	Coumestan	Sativol
0.000	[Flavonol]-A(2OMe)-B(none)	Flavonol	Galangin 5,7-dimethyl ether
0.000	[Chalcone]-A(1OH, 1OMe, 1Formyl)-B(1OH)	Chalcone	Isoneobavachalcone
0.000	[2'-Hydroxychalcone]-A(1OH, 1OMe, 1Formyl)-B(1OH)	2'-Hydroxychalcone	Neobavachalcone
0.000	[2'-Hydroxychalcone]-A(1OH, 2OMe, 1Methyl)-B(none)	2'-Hydroxychalcone	Aurentiacin
0.000	[2'-Hydroxychalcone]-A(2OH, 1OMe, 2Methyl)-B(none)	2'-Hydroxychalcone	2',4'-Dihydroxy-6'-methoxy-3',5'-dimethylchalcone
0.000	[UBR-type derivative / 2'-Oxocyclohexa-3',6'-dienyl-type Chalcone]-A(1OH, 1OMe, 2Methyl)-B(none)	UBR-type derivative / 2'-Oxocyclohexa-3',6'-dienyl-type Chalcone	Ceroptene
0.000	[UBR-type derivative / 2'-Oxo-3'-enyl-0-hydroxy-type Chalcone]-A(1Methoxycarbonylmethyl)-B(none)	UBR-type derivative / 2'-Oxo-3'-enyl-0-hydroxy-type Chalcone	Infectocaryone
0.000	[Flavanone]-A(1OMe, 1Methyl)-B(1OMe)	Flavanone	7,4'-Dimethoxy-6-C-methylflavanone
0.000	[Flavanone]-A(2OMe, 1Methyl)-B(none)	Flavanone	5,7-Dimethoxy-6-C-methylflavanone
0.000	[Flavanone]-A(1OH, 1OMe, 2Methyl)-B(none)	Flavanone	5-Hydroxy-7-methoxy-6,8-di-C-methylflavanone
0.000	[Flavanone]-A(1OH, 1OMe, 2Methyl)-B(none)	Flavanone	6,8-Di-C-methylpinocembrin 5-methyl ether
0.000	[Flavanone]-A(2OH, 1Formyl, 1Methyl)-B(none)	Flavanone	Lawinal
0.000	[Flavone]-A(1OH, 1OMe, 1Methyl)-B(1OH)	Flavone	8-Demethylsideroxylin
0.000	[Flavone]-A(2OH, 2Methyl)-B(1OH)	Flavone	Syzalterin
0.000	[Flavone]-A(1OH, 1([@@]-Methylenedioxy))-B(1OH)	Flavone	Kanzakiflavone 2
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe)-B(none)	Flavonol	Galangin 3,7-dimethyl ether
0.000	[Flavonol (3-OMe)]-A(2OH, 1Methyl)-B(none)	Flavonol	5,7-Dihydroxy-3-methoxy-8-methylflavone
0.000	[Flavonol]-A(1OH, 1OMe, 1Methyl)-B(none)	Flavonol	3,5-Dihydroxy-7-methoxy-8-methylflavone
0.000	[Flavonol]-A(2OH, 2Methyl)-B(none)	Flavonol	6,8-Dimethylgalangin
0.000	[CCS-type derivative / [3,2']-Epoxymethanoflavone]-A(1OH)-B(2OH)	CCS-type derivative / [3,2']-Epoxymethanoflavone	Peltogynin
0.000	[CCS-type derivative / [3,2']-Epoxymethanoflavone]-A(1OH)-B(2OH)	CCS-type derivative / [3,2']-Epoxymethanoflavone	Mopanin
0.000	[3-DehydroxyAnthocyanidin]-A(2OH, 1OMe)-B(1OMe)	3-DehydroxyAnthocyanidin	Carajurin
0.000	[Isoflavone]-A(1OH)-B(1OH, 1([@@]-Methylenedioxy))	Isoflavone	2-Hydroxypseudobaptigenin
0.000	[Isoflavone]-A(1OH)-B(1OH, 1([@@]-Methylenedioxy))	Isoflavone	Glyzaglabrin
0.000	[Isoflavone]-A(2OH)-B(1([@@]-Methylenedioxy))	Isoflavone	5-Hydroxypseudobaptigenin
0.000	[Isoflavone]-A(1OH, 1([@@]-Methylenedioxy))-B(1OH)	Isoflavone	Irisone B
0.000	[Isoflavone]-A(1OH, 1([@@]-Methylenedioxy))-B(1OH)	Isoflavone	Irilone
0.000	[UBR-type derivative / [2',5']-Benzoquinonyl-type Isoflavone]-A(1OH)-B(1OMe)	UBR-type derivative / [2',5']-Benzoquinonyl-type Isoflavone	Bowdichione
0.000	[Pterocarpan]-A(1OMe)-B(1([@@]-Methylenedioxy))	Pterocarpan	Pterocarpin
0.000	[3-Phenylcoumarin]-A(1OH)-B(1OH, 1([@@]-Methylenedioxy))	3-Phenylcoumarin	7,2'-Dihydroxy-4',5'-methylenedioxy-3-phenylcoumarin
0.000	[4-phenylcoumarin]-A(1OH, 2OMe)-B(none)	4-phenylcoumarin	Kuhlmannin
0.000	[4-phenylcoumarin]-A(2OMe)-B(1OH)	4-phenylcoumarin	4'-Hydroxy-5,7-dimethoxy-4-phenylcoumarin
0.000	[4-phenylcoumarin]-A(1OH, 1OMe)-B(1OMe)	4-phenylcoumarin	5-Hydroxy-7,4'-dimethoxy-4-phenylcoumarin
0.000	[CCS-type derivative / [5,2']-Epoxy-4-phenylcoumarin]-A(1OMe)-B(2OH)	CCS-type derivative / [5,2']-Epoxy-4-phenylcoumarin	4',5'-Dihydroxy-7-methoxy-5,2'-oxido-4-phenylcoumarin

Level: 3, プリカーサーm/z: 162.95044

Splash: splash10-0006-0900000000-d89deb99f78985ea6e37

m/z	Int.	NL	Rel.Int.
144.91	25509	18	1000
134.90	2420	28	94

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
1512	35.02	299.07591	0.0000	1.19	[M+H]+	(4 names) Benzoyl glucuronide (Benzoic acid); D-Prephenyllactate; Demethoxybergenin; (-)-Demethoxybergenin	ALL 3 KG 1 KN 1 HM 1	MS2 MS3	0.050		2
	35.02	281.06550	-18.0104	-0.31	[M-H2O+H]+	(4 names) Benzoyl glucuronide (Benzoic acid); D-Prephenyllactate; Demethoxybergenin; (-)-Demethoxybergenin	ALL 3 KG 1 KN 1 HM 1				1

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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