ピーク情報

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Peak #9513 MN MID: SE205_S02_M91

m/z: 413.21848, RT: 50.10, 強度: 238795, ログ強度: 1.91, アダクト: [M-H]-, 共有数（同様のピークを含むサンプル数）: 8

DB検索結果: (10 names) (4R,5S,7R,11x)-11,12-Dihydroxy-1(10)-spirovetiven-2-one 12-glucoside;methyl 6,8-epidioxy-5,15-dihydroperoxy-9,11,13-eicosatrienoate;methyl 5-hydroperoxy-6,8,9,11-bisepidioxy-12,14-eicosadienoate;Dicta...

DBごとのヒット数: ALL 9 KG 2 KN 2 HM 2 LM 3

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
C21H34O8	414.22537	0.942	(4R,5S,7R,11x)-11,12-Dihydroxy-1(10)-spirovetiven-2-one 12-glucoside	HMDB: HMDB0030895, HMDB0302960
C21H34O8	414.22537	0.942	methyl 6,8-epidioxy-5,15-dihydroperoxy-9,11,13-eicosatrienoate	LipidMAPS: LMFA03050014
C21H34O8	414.22537	0.942	methyl 5-hydroperoxy-6,8,9,11-bisepidioxy-12,14-eicosadienoate	LipidMAPS: LMFA01040061
C21H34O8	414.22537	0.942	Dictamnoside L	KNApSAcK: C00045849
C21H34O8	414.22537	0.942	methyl 9,11-epidioxy-12,15-dihydroperoxy-5,7,13-eicosatrienoate	LipidMAPS: LMFA03050013
C21H34O8	414.22537	0.942	(4R,5S,7R,11S)-11,12-Dihydroxy-1(10)-spirovetiven-2-one 11-glucoside	HMDB: HMDB0033150
C21H34O8	414.22537	0.942	Dendromoniliside A	KNApSAcK: C00044701
C22H30O4N4	414.22671	-2.286	Distigmine	KEGG: [2]C16823
C22H30O4N4	414.22671	-2.286	Tentoxin	KEGG: C08441 KNApSAcK: C00001521

MSnスペクトル情報

Level: 2, プリカーサーm/z: 413.21854

Splash: splash10-0udi-0109000000-13034cf45f34b3f33e2d

m/z	Int.	NL	Rel.Int.
353.29	11281	60	1000
147.06	1750	266	155
371.25	1218	42	107

関連ピーク情報

ピーク番号	保持時間 (min)	m/z	m/z差分	ログ強度	アダクト	DB検索結果	ヒット数	MSn	共有数
	50.09	459.22405	46.0056	1.72	[M+HCOOH-H]-, [M-H2O-H]-, [M+CH3OH-H]-	(10 names) (4R,5S,7R,11x)-11,12-Dihydroxy-1(10)-spirovetiven-2-one 12-glucoside; methyl 6,8-epidioxy-5,15-dihydroperoxy-9,11,13-eicosatrienoate; methyl 5-hydroperoxy-6,8,9,11-bisepidioxy-12,14-eicosadienoate; Dicta...	ALL 9 KG 2 KN 2 HM 2 LM 3	MS2	9
	49.84	430.24513	17.0266	-0.06	[M+NH3-H]-	(10 names) (4R,5S,7R,11x)-11,12-Dihydroxy-1(10)-spirovetiven-2-one 12-glucoside; methyl 6,8-epidioxy-5,15-dihydroperoxy-9,11,13-eicosatrienoate; methyl 5-hydroperoxy-6,8,9,11-bisepidioxy-12,14-eicosadienoate; Dicta...	ALL 9 KG 2 KN 2 HM 2 LM 3		1
9513	50.10	413.21848	0.0000	1.91	[M-H]-	(10 names) (4R,5S,7R,11x)-11,12-Dihydroxy-1(10)-spirovetiven-2-one 12-glucoside; methyl 6,8-epidioxy-5,15-dihydroperoxy-9,11,13-eicosatrienoate; methyl 5-hydroperoxy-6,8,9,11-bisepidioxy-12,14-eicosadienoate; Dicta...	ALL 9 KG 2 KN 2 HM 2 LM 3	MS2	8

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

関連ピーク情報