ピーク情報

イヌカタヒバ

pos

Peak #4628 MN MID: SE205_S02_M90

m/z: 582.20143, RT: 44.43, 強度: 59454, ログ強度: 1.25, 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: (2 names) GW 3965;Met-Gln-Cys-Asn-Ser

DBごとのヒット数: ALL 2 KG 1 HM 1

FlavonoidSearch最大スコア MS2: -, MS3: 0.056

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
C33H31O3NClF3	581.19446	-0.524	GW 3965	HMDB: HMDB0252991 KEGG: C15631
C20H35O9N7S2	581.19377	0.661	Met-Gln-Cys-Asn-Ser	HMDB: HMDB0254490

Level: 2, プリカーサーm/z: 582.20056

Splash: splash10-0bvi-0145920000-8b38c560efc3922cc663

m/z	Int.	NL	Rel.Int.
209.03	1656	373	1000
429.07	1287	153	777
383.21	760	199	459
443.15	641	139	386
411.17	536	171	323
563.32	487	19	293
403.14	388	179	234
369.18	366	213	221
564.32	336	18	202
461.06	249	121	150
373.02	246	209	148
371.93	226	210	136
312.19	221	270	133
401.18	213	181	128
192.99	199	389	120
251.06	182	331	109
550.32	181	32	109
181.06	133	401	80
333.25	117	249	70
177.05	113	405	67

Level: 3, プリカーサーm/z: 209.07843

Splash: splash10-003r-0900000000-76f44f658256f786f452

m/z	Int.	NL	Rel.Int.
181.05	478	28	1000
177.05	307	32	641
148.97	121	60	252
153.02	32	56	67
92.76	30	116	63
144.98	26	64	55
151.01	26	58	53

Level: 3, プリカーサーm/z: 429.13995

Splash: splash10-03xr-0008900000-5f53b0b65cc5cfc2fd1b

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.056	[Flavanone]-A(1OH, 1OMe, 1(C-Prenyl))-B(3OMe)	Flavanone	Heteroflavanone B
0.000	[Flavan 3-ol]-A(2OH)-B(2OH)-C(1(O-<1-Hydroxy-6-oxo-2-cyclohexene-1-carbonyl>))	Flavan 3-ol	Catechin 3-O-(1-hydroxy-6-oxo-2-cyclohexene-1-carboxylate)
0.000	[Rotenone]-A(1([2,3:@@]-(5-(1,2-Dihydroxy-1-methylethyl)dihydrofurano)))-B(2OMe)	Rotenone	Amorphigenol
0.000	[12a-Hydroxyrotenoid 12-ol]-A(1([2,3:@@]-(5-(1-Hydroxymethylvinyl)dihydrofurano)))-B(2OMe)	12a-Hydroxyrotenoid 12-ol	12-Dihydrodalbinol

m/z	Int.	NL	Rel.Int.
411.30	387	18	1000
369.27	302	60	779
339.29	36	90	94
351.17	36	78	92