ピーク情報

（ふき類）ふきのとう花序生

pos

Peak #12073 MN MID: SE114_S062581_M90

m/z: 351.16221, RT: 72.48, 強度: 158365, ログ強度: 1.72, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 1

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	-0.696	S-Petasitin	KNApSAcK: C00050236
C19H26O4S	350.15518	-0.696	Petasone A	KNApSAcK: C00050186, C00050187
C19H26O4S	350.15518	-0.696	S-Petasitolide A	KNApSAcK: C00017402, C00017403
C19H26O4S	350.15518	-0.696	Eremopetasin sulfoxide	HMDB: HMDB0032003
C19H26O4S	350.15518	-0.696	Propargite	HMDB: HMDB0256819 KEGG: C18602

Level: 2, プリカーサーm/z: 351.16211

Splash: splash10-001i-0090000000-47ff22de738b66d0d304

m/z	Int.	NL	Rel.Int.
233.20	54019	118	1000
215.08	18617	136	344

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: 233.10657

Splash: splash10-066r-0590000000-0b02a4b517187e241b8e

m/z	Int.	NL	Rel.Int.
215.11	7094	18	1000
187.14	2920	46	411
205.08	2680	28	377
159.10	1205	74	169
177.13	979	56	138
151.01	593	82	83
163.08	363	70	51

Level: 3, プリカーサーm/z: 215.05014

Splash: splash10-0006-0900000000-5393d057d19748cd0a6d

m/z	Int.	NL	Rel.Int.
144.99	4509	70	1000
158.95	591	56	131