ピーク情報

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pos

Peak #6357 MN MID: SE61_S21_M90

m/z: 433.17090, RT: 45.30, 強度: 53965, ログ強度: 1.15, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 4

DB検索結果: (6 names) Benzyl gentiobioside;Osmanthuside H;(-)-Osmanthuside H;Zizybeoside I;;8-O-Acetylmussaenoside

DBごとのヒット数: ALL 5 KG 1 KN 3 LM 1

FlavonoidSearch最大スコア MS2: -, MS3: 0.188

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
C19H28O11	432.16316	1.078	Benzyl gentiobioside	HMDB: HMDB0041515 KNApSAcK: C00053974
C19H28O11	432.16316	1.078	Osmanthuside H	KNApSAcK: C00030899
C19H28O11	432.16316	1.078	Zizybeoside I	HMDB: HMDB0034954 KEGG: C17564 KNApSAcK: C00032551
C19H28O11	432.16316	1.078		LipidMAPS: LMPR0102070053, LMPR0102070054
C19H28O11	432.16316	1.078	8-O-Acetylmussaenoside	KNApSAcK: C00036667

MSnスペクトル情報

Level: 2, プリカーサーm/z: 433.17087

Splash: splash10-00di-0590000000-dc4c82fa3dec13b3ea36

m/z	Int.	NL	Rel.Int.
271.15	18878	162	1000
139.10	5613	294	297
185.01	2753	248	145
415.09	2218	18	117
173.06	1735	260	91
157.10	1712	276	90
167.03	1689	266	89
276.97	1252	156	66
231.03	1205	202	63

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.071	[Flavone]-A(2OH, 1(C-Glu))-B(1OH)	Flavone	Neovitexin
0.071	[Flavone]-A(2OH, 1(C-Glu))-B(1OH)	Flavone	Vitexin
0.071	[Flavone]-A(2OH, 1(C-Glu))-B(1OH)	Flavone	Isovitexin
0.071	[Flavonol]-A(1OH, 1(C-Glu))-B(1OH)	Flavonol	8-C-Glucosylresokaempferol
0.071	[Isoflavone]-A(1OH, 1(C-Glu))-B(2OH)	Isoflavone	8-Glucosyl 3'-hydroxydaidzein
0.071	[Isoflavone]-A(2OH, 1(C-Glu))-B(1OH)	Isoflavone	Genistein 8-C-glucoside
0.000	[Flavone]-A(3OMe)-B(4OMe)	Flavone	Agehoustin B
0.000	[Flavone]-A(4OMe)-B(3OMe)	Flavone	5,6,7,8,3',4',5'-Heptamethoxyflavone
0.000	[Flavone]-A(4OMe)-B(3OMe)	Flavone	Agecorynin C
0.000	[Chalcone]-A(2OMe, 1([@@]-Methylenedioxy))-B(4OMe)	Chalcone	2,3,4,5,2',6'-Hexamethoxy-3',4'-methylenedioxychalcone
0.000	[Flavanone]-A(1OH, 1([2,3:@@]-(4-(p-Hydroxyphenyl)-6-oxodihydropyrano)))-B(1OMe)	Flavanone	Calomelanol G
0.000	[Flavone]-A(2OH, 1(C-Galactosyl))-B(1OH)	Flavone	8-C-beta-D-Galactopyranosylapigenin
0.000	[Flavone]-A(2OH, 1(C-Galactosyl))-B(1OH)	Flavone	6-C-beta-D-Galactosylapigenin
0.000	[Flavone]-A(2OH, 1(C-Chinovosyl))-B(2OH)	Flavone	6-C-Chinovopyranosylluteolin
0.000	[Flavone]-A(2OH, 1(C-Fucosyl))-B(2OH)	Flavone	6-C-Fucopyranosylluteolin
0.000	[Flavone]-A(2OH, 1(C-Rhamnosyl))-B(2OH)	Flavone	8-C-Rhamnopyranosylluteolin
0.000	[Flavone]-A(2OH, 1(C-Xylosyl))-B(1OH, 1OMe)	Flavone	5,7,4'-Trihydroxy-3'-methoxyflavone-8-C-beta-D-xylopyranoside
0.000	[CCS-type derivative / [2',3]-Prenyloxidoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OMe)	CCS-type derivative / [2',3]-Prenyloxidoflavone	Artocommunol CA
0.000	[Flavonol (3-OMe)]-A(3OMe)-B(3OMe)	Flavonol	3,5,6,7,3',4',5'-Heptamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(3OMe)-B(3OMe)	Flavonol	Benthamitin
0.000	[Flavonol (3-OMe)]-A(3OMe)-B(3OMe)	Flavonol	Hibiscetin heptamethyl ether
0.000	[Flavonol (3-OMe)]-A(4OMe)-B(2OMe)	Flavonol	3,5,6,7,8,3',4'-Heptamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OMe, 1([@@]-Methylenedioxy))-B(1OH, 2OMe)	Flavonol	3'-Hydroxy-3,5,8,4',5'-pentamethoxy-6,7-methylenedioxyflavone

Level: 3, プリカーサーm/z: 139.02847

Splash: splash10-006x-9400000000-0dcd71f82433700b6854

m/z	Int.	NL	Rel.Int.
94.99	354	44	1000
120.94	259	18	730
68.96	88	70	248
80.99	53	58	148
97.00	25	42	70
111.21	21	28	60

Level: 3, プリカーサーm/z: 271.03314

Splash: splash10-0fk9-0590000000-4407dc7037f5da5ba3b6

m/z	Int.	NL	Rel.Int.
271.14	149	-0	1000
153.00	112	118	749
224.97	61	46	409
229.10	39	42	257
119.10	26	152	172
210.72	23	60	152
162.84	19	108	126
90.81	18	180	119
156.95	18	114	119
187.16	11	84	73
270.54	9	0	63
203.22	8	68	50

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.188	[2'-Hydroxychalcone]-A(2OH)-B(1OMe)	2'-Hydroxychalcone	Isoliquiritigenin 4-methyl ether
0.188	[2'-Hydroxychalcone]-A(2OH)-B(1OMe)	2'-Hydroxychalcone	2',5'-Dihydroxy-4-methoxychalcone
0.174	[Flavonol]-A(2OH)-B(none)	Flavonol	Galangin
0.167	[Flavone]-A(2OH)-B(1OH)	Flavone	5,8,2'-Trihydroxyflavone
0.167	[Flavone]-A(2OH)-B(1OH)	Flavone	5,7,2'-Trihydroxyflavone
0.167	[Flavone]-A(2OH)-B(1OH)	Flavone	Apigenin
0.167	[Flavanone]-A(1OH)-B(1OMe)	Flavanone	4'-Methylliquiritigenin
0.167	[Flavanone]-A(1OMe)-B(1OH)	Flavanone	Methyl-liquiritigenin
0.158	[Isoflavone]-A(2OH)-B(1OH)	Isoflavone	Demethyltexasin
0.158	[Isoflavone]-A(2OH)-B(1OH)	Isoflavone	8-Hydroxydaidzein
0.158	[Isoflavone]-A(2OH)-B(1OH)	Isoflavone	5,7,2'-Trihydroxyisoflavone
0.158	[Isoflavone]-A(2OH)-B(1OH)	Isoflavone	5,7,3'-Trihydroxyisoflavone
0.158	[Isoflavone]-A(2OH)-B(1OH)	Isoflavone	Genistein
0.120	[Flavonol]-A(1OH)-B(1OH)	Flavonol	Resokaempferol
0.118	[2'-Hydroxychalcone]-A(1OH, 1OMe)-B(1OH)	2'-Hydroxychalcone	Isoliquiritigenin 4'-methyl ether
0.118	[2'-Hydroxychalcone]-A(2OH, 1OMe)-B(none)	2'-Hydroxychalcone	Flemichapparin
0.118	[2'-Hydroxychalcone]-A(2OH, 1OMe)-B(none)	2'-Hydroxychalcone	Larrein
0.118	[2'-Hydroxychalcone]-A(2OH, 1OMe)-B(none)	2'-Hydroxychalcone	Cardamonin
0.118	[2'-Hydroxychalcone]-A(2OH, 1OMe)-B(none)	2'-Hydroxychalcone	2',6'-Dihydroxy-4'-methoxychalcone
0.118	[Isoflavanone]-A(1OH)-B(1OMe)	Isoflavanone	Dihydroformononetin
0.105	[Flavone]-A(3OH)-B(none)	Flavone	Baicalein
0.105	[Flavone]-A(3OH)-B(none)	Flavone	Norwogonin
0.105	[Flavone]-A(1OH)-B(2OH)	Flavone	7,3',4'-Trihydroxyflavone
0.105	[Flavone]-A(1OH)-B(2OH)	Flavone	5,2',5'-Trihydroxyflavone
0.105	[Flavanone]-A(1OH, 1OMe)-B(none)	Flavanone	7-Hydroxy-8-methoxyflavanone
0.105	[Flavanone]-A(1OH, 1OMe)-B(none)	Flavanone	Alpinetin
0.105	[Flavanone]-A(1OH, 1OMe)-B(none)	Flavanone	Pinostrobin
0.105	[Anthocyanidin]-A(2OH)-B(1OH)	Anthocyanidin	Pelargonidin
0.100	[Isoflavone]-A(1OH)-B(2OH)	Isoflavone	3'-Hydroxydaidzein
0.100	[Isoflavone]-A(1OH)-B(2OH)	Isoflavone	2'-Hydroxydaidzein
0.050	[Chalcone]-A(1OH)-B(1OH, 1OMe)	Chalcone	Echinatin
0.050	[Chalcone]-A(1OH, 1OMe)-B(1OH)	Chalcone	Isoliquiritigenin 2'-methy ether
0.000	[Pterocarpan]-A(1OH)-B(1OMe)	Pterocarpan	Medicarpin
0.000	[Pterocarpan]-A(1OMe)-B(1OH)	Pterocarpan	Isomedicarpin
0.000	[Aurone]-A(1OH)-B(2OH)	Aurone	Sulfuretin
0.000	[Aurone]-A(2OH)-B(1OH)	Aurone	4,6,4'-Trihydroxyaurone
0.000	[UBR-type derivative / 2',5'-Dioxo-3'-cyclopentenyl-type Calcone (alpha-OMe)]-A(1OMe)-B(none)	UBR-type derivative / 2',5'-Dioxo-3'-cyclopentenyl-type Calcone	Methyllucidone
0.000	[UBR-type derivative / 3',5'-Dioxo-1'-cyclopentenyl-type Dihydrocalcone]-A(3Methyl)-B(none)	UBR-type derivative / 3',5'-Dioxo-1'-cyclopentenyl-type Dihydrocalcone	4-Hydrocinnamoyl-2,2,5-trimethyl-4-cyclopentene-1,3-dione
0.000	[Flavanone]-A(2OH, 1Methyl)-B(none)	Flavanone	Strobopinin
0.000	[Flavanone]-A(2OH, 1Methyl)-B(none)	Flavanone	Cryptostrobin
0.000	[Flavan]-A(1OMe, 1Methyl)-B(1OH)	Flavan	4'-Hydroxy-7-methoxy-8-methylflavan
0.000	[Flavan]-A(1OH)-B(1([@@]-Methylenedioxy))	Flavan	7-Hydroxy-3',4'-methylenedioxyflavan
0.000	[Flavan]-A(2OMe)-B(none)	Flavan	Tephrowatsin E
0.000	[Flavan]-A(1OH, 1OMe, 1Methyl)-B(none)	Flavan	7-Hydroxy-5-methoxy-6-methylflavan
0.000	[3-DehydroxyAnthocyanidin]-A(2OH)-B(2OH)	3-DehydroxyAnthocyanidin	Luteolinidin
0.000	[isoflavene]-A(1OH)-B(1OH, 1OMe)	isoflavene	Haginin B
0.000	[2-Phenylbenzofuran]-A(1OMe)-B(1OH, 1OMe)	2-Phenylbenzofuran	Vignafuran
0.000	[2-Phenylbenzofuran]-A(1([@@]-Methylenedioxy))-B(2OH)	2-Phenylbenzofuran	2',4'-Dihydroxy-5,6-methylenedioxy-2-phenylbenzofuran
0.000	[Dalbergiquinol]-A(1OH, 2OMe)-B(none)	Dalbergiquinol	5-Hydroxy-2,4-dimethoxydalbergiquinol
0.000	[UBR-type derivative / [2,5]-Benzoquinonyl-type Dalbergiquinol]-A(1OMe)-B(1OH)	UBR-type derivative / [2,5]-Benzoquinonyl-type Dalbergiquinol	4'-Hydroxy-4-methoxydalbergione