ピーク情報

ポプラ, 幼植物, 地上部

pos

Peak #3828 MN MID: SE205_S08_M90

m/z: 458.16615, RT: 44.68, 強度: 78253, ログ強度: 1.29, 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: (6 names) Amygdalin;Calanthoside;Calanthoside A; Glucoindican;Mandelonitrile sophoroside;Bisindolylmaleimide IX

DBごとのヒット数: ALL 4 KG 1 KN 1 HM 2

FlavonoidSearch最大スコア MS2: -, 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
C20H27O11N	457.15841	1.015	Amygdalin	HMDB: HMDB0035030 KEGG: C08325 KNApSAcK: C00001437
C20H27O11N	457.15841	1.015	Calanthoside	KNApSAcK: C00026979, C00026980
C20H27O11N	457.15841	1.015	Mandelonitrile sophoroside	HMDB: HMDB0038475
C25H23O2N5S	457.15725	3.563	Bisindolylmaleimide IX	HMDB: HMDB0257262

Level: 2, プリカーサーm/z: 458.16568

Splash: splash10-014m-0190000000-24028c9bfa8152b3c7c2

m/z	Int.	NL	Rel.Int.
266.95	5070	191	1000
243.04	4019	215	792
249.03	3676	209	724
284.95	1151	173	227
260.97	980	197	193
282.82	734	175	144
164.99	688	293	135
189.09	546	269	107
230.93	487	227	96
278.00	457	180	90
180.96	439	277	86
199.05	429	259	84
160.90	351	297	69
136.95	336	321	66
278.80	316	179	62
439.87	283	18	55
203.09	262	255	51

Level: 3, プリカーサーm/z: 243.04173

Splash: splash10-0002-0900000000-6f9123e14e7ac4458c54

m/z	Int.	NL	Rel.Int.
199.01	2759	44	1000
181.00	406	62	147
225.12	200	18	72

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Isoflavan]-A(1OH)-B(1OH)	Isoflavan	Equol
[Dihydrochalcone]-A(2OH)-B(none)	Dihydrochalcone	2',4'-Dihydroxydihydrochalcone
[Flavan]-A(1OH)-B(1OH)	Flavan	7,4'-Dihydroxyflavan
[Flavan]-A(2OH)-B(none)	Flavan	5,7-Dihydroxyflavan
[2-Phenylbenzofuran]-A(1OH)-B(2OH)	2-Phenylbenzofuran	6,2',4'-Trihydroxy-2-phenylbenzofuran

Level: 3, プリカーサーm/z: 266.94925

Splash: splash10-000b-0590000000-e4a73dc3ca014e9a6d63

m/z	Int.	NL	Rel.Int.
248.93	404	18	1000
136.91	176	130	436
231.05	114	36	282
188.93	95	78	234
213.33	90	54	223
191.09	69	76	171
206.93	61	60	149
180.93	60	86	147
176.97	39	90	95
185.09	39	82	95
201.11	31	66	77
202.82	27	64	67
219.11	23	48	56