ピーク情報

（ふき類）ふき葉柄生

pos

Peak #4019 MN MID: SE114_S062561_M90

m/z: 351.16267, RT: 99.73, 強度: 3282, ログ強度: 0.12, 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) S-Petasitin;Petasone A;(+)-Petasone A;S-Petasitolide A;Propargite;Eremopetasin sulfoxide

DBごとのヒット数: ALL 5 KG 1 KN 3 HM 1

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
C19H26O4S	350.15518	0.612	S-Petasitin	KNApSAcK: C00050236
C19H26O4S	350.15518	0.612	Petasone A	KNApSAcK: C00050186, C00050187
C19H26O4S	350.15518	0.612	S-Petasitolide A	KNApSAcK: C00017402, C00017403
C19H26O4S	350.15518	0.612	Eremopetasin sulfoxide	HMDB: HMDB0032003
C19H26O4S	350.15518	0.612	Propargite	HMDB: HMDB0256819 KEGG: C18602

Level: 2, プリカーサーm/z: 351.16183

Splash: splash10-001i-0090000000-3ba861fc341b1e2c5249

m/z	Int.	NL	Rel.Int.
233.15	1480	118	1000
215.05	470	136	317

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Isoflavone]-A(1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	Isoflavone	Lanceolone�G4'-Hydroxy-5-methoxy-6'',6''-dimethylpyrano[2'',3'':7,8]isoflavone
[Isoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OMe)	Isoflavone	4'-O-methylalpinumisoflavone
[Isoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OMe)	Isoflavone	4'-O-Methylderrone
[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1([@@]-Methylenedioxy))	2'-Hydroxychalcone	Glabrachromene II
[Flavanone]-A(1([@@]-Methylenedioxy))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Ovaliflavanone B
[Flavone]-A(1([2,3:@@]-(5,5-Dimethyl-4-hydroxy-4,5,3a,6a-tetrahydro-furo[2,3-b]furano)))-B(none)	Flavone	Semiglabrinol
[Pterocarpan]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1([@@]-Methylenedioxy))	Pterocarpan	Neorautenane
[Pterocarpan]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1([@@]-Methylenedioxy))	Pterocarpan	Leiocarpin

Level: 3, プリカーサーm/z: 233.14966

Splash: splash10-066r-1890000000-15877a344356df9768a6

m/z	Int.	NL	Rel.Int.
215.02	196	18	1000
205.08	96	28	488
153.02	48	80	242
163.10	44	70	222
159.26	42	74	213
188.92	30	44	153
149.08	25	84	126
177.44	22	56	111
80.98	22	152	109
173.01	20	60	100
160.93	16	72	83
187.29	16	46	82
176.84	15	56	77
56.58	12	177	61
119.11	12	114	61
350.32	11	-117	57