ピーク情報

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Peak #3296 MN MID: SE205_S02_M90

m/z: 307.17637, RT: 37.55, 強度: 8794, ログ強度: 0.42, 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: (5 names) Feruloylagmatine;Bz-Arg-OEt;Propentofylline;1-(beta-D-Glucopyranosyloxy)-3-octanone;Creoside II

DBごとのヒット数: ALL 5 KG 2 KN 1 HM 2

FlavonoidSearch最大スコア MS2: 0.167, MS3: 0.214

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
C15H22O3N4	306.16919	-0.329	Feruloylagmatine	HMDB: HMDB0037107 KEGG: C18325
C15H22O3N4	306.16919	-0.329	Bz-Arg-OEt	HMDB: HMDB0249494 KEGG: C01670
C15H22O3N4	306.16919	-0.329	Propentofylline	HMDB: HMDB0256822
C14H26O7	306.16785	4.040	1-(beta-D-Glucopyranosyloxy)-3-octanone	HMDB: HMDB0031315
C14H26O7	306.16785	4.040	Creoside II	KNApSAcK: C00030023

MSnスペクトル情報

Level: 2, プリカーサーm/z: 307.17606

Splash: splash10-0006-0290000000-91806011e7fc7f3ecc19

m/z	Int.	NL	Rel.Int.
290.16	30491	17	1000
289.09	4979	18	163
113.99	4885	193	160
176.98	4407	130	144
247.13	3677	60	120
114.98	2923	192	95
248.13	2317	59	75
265.13	1609	42	52

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.167	[Flavanone]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	Flavanone	Isolonchocarpin
0.167	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	2'-Hydroxychalcone	Lonchocarpin
0.083	[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: 290.16486

Splash: splash10-0002-0190000000-af9974c0dfa30c56774e

m/z	Int.	NL	Rel.Int.
247.14	16588	43	1000
113.96	1368	176	82
273.19	1077	17	64
176.99	1026	113	61

Level: 3, プリカーサーm/z: 289.08527

Splash: splash10-0002-0090000000-01d7f1b1dbc049286240

m/z	Int.	NL	Rel.Int.
245.06	1884	44	1000
271.11	1099	18	583
261.08	1012	28	537
247.12	368	42	195
203.00	137	86	72

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.214	[2'-Hydroxychalcone]-A(2OH)-B(3OH)	2'-Hydroxychalcone	Robtein
0.214	[2'-Hydroxychalcone]-A(3OH)-B(2OH)	2'-Hydroxychalcone	Neoplathymenin
0.214	[2'-Hydroxychalcone]-A(3OH)-B(2OH)	2'-Hydroxychalcone	Okanin
0.200	[Flavanone]-A(2OH)-B(2OH)	Flavanone	Plathymenin
0.200	[Flavanone]-A(2OH)-B(2OH)	Flavanone	Isookanin
0.182	[Dihydroflavonol]-A(2OH)-B(1OH)	Dihydroflavonol	Aromadendrin
0.167	[2'-Hydroxychalcone]-A(3OH)-B(2OH)	2'-Hydroxychalcone	3,4,2',4',6'-Pentahydroxychalcone
0.167	[Isoflavanone]-A(2OH)-B(2OH)	Isoflavanone	Dalbergioidin
0.154	[Flavanone]-A(2OH)-B(2OH)	Flavanone	5,7,2',6'-Tetrahydroxyflavanone
0.154	[Flavanone]-A(2OH)-B(2OH)	Flavanone	5,7,2',5'-Tetrahydroxyflavanone
0.154	[Flavanone]-A(2OH)-B(2OH)	Flavanone	Eriodictyol
0.154	[Flavanone]-A(2OH)-B(2OH)	Flavanone	Steppogenin
0.154	[Flavanone]-A(3OH)-B(1OH)	Flavanone	Carthamidin
0.154	[Flavanone]-A(3OH)-B(1OH)	Flavanone	Isocarthamidin
0.125	[Dihydroflavonol]-A(1OH)-B(2OH)	Dihydroflavonol	Fustin
0.125	[Dihydroflavonol]-A(2OH)-B(1OH)	Dihydroflavonol	3,5,7,2'-Tetrahydroxyflavanone
0.000	[Dihydrochalcone]-A(1OH)-B(2OH, 1OMe)	Dihydrochalcone	Loureirin D
0.000	[Dihydrochalcone]-A(2OH, 1OMe)-B(1OH)	Dihydrochalcone	Asebogenin
0.000	[Dihydrochalcone]-A(2OH, 1OMe)-B(1OH)	Dihydrochalcone	4,2',4'-Trihydroxy-6'-methoxydihydrochalcone
0.000	[Dihydrochalcone]-A(1OH, 1OMe)-B(2OH)	Dihydrochalcone	Dihydrocalythropsin
0.000	[Dihydrochalcone]-A(2OH)-B(1OH, 1OMe)	Dihydrochalcone	4,2',4'-Trihydroxy-3-methoxydihydrochalcone
0.000	[Dihydrochalcone]-A(3OH)-B(1OMe)	Dihydrochalcone	2',4',6'-Trihydroxy-4-methoxydihydrochalcone
0.000	[Auronol]-A(1OH)-B(2OH)	Auronol	2,6,3',4'-Tetrahydroxy-2-benzylcoumaranone
0.000	[Auronol]-A(2OH)-B(1OH)	Auronol	Maesopsin
0.000	[alpha-Hydroxychalcone]-A(2OH)-B(2OH)	alpha-Hydroxychalcone	3,4,2',4',alpha-Pentahydroxychalcone
0.000	[Dihydrochalcone alpha-ol]-A(1OH, 1OMe)-B(1OH)	Dihydrochalcone alpha-ol	4,4',alpha-Trihydroxy-2'-methoxydihydrochalcone
0.000	[Dihydrochalcone alpha-ol]-A(2OH)-B(1OMe)	Dihydrochalcone alpha-ol	2',4',alpha-Trihydroxy-4-methoxydihydrochalcone
0.000	[2-Hydroxyflavanone]-A(2OH)-B(1OH)	2-Hydroxyflavanone	2,5,7,4'-Tetrahydroxyflavanone
0.000	[CCS-type derivative / [4,2']-Epoxyflavan 3-ol]-A(2OH)-B(1OH)	CCS-type derivative / [4,2']-Epoxyflavan 3-ol	Cyanomaclurin
0.000	[CCS-type derivative / [4,2']-Epoxyflavan 3-ol]-A(1OH)-B(2OH)	CCS-type derivative / [4,2']-Epoxyflavan 3-ol	6,12-Mehthano-6H,12H-dibenzo[b,f][1,5]dioxocin-2,3,9,13-tetrol
0.000	[Flavan]-A(1OH)-B(2OH, 1OMe)	Flavan	7,3',5'-Trihydroxy-4'-methoxyflavan