ピーク情報

イヌカタヒバ

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Peak #9510 MN MID: SE205_S02_M91

m/z: 459.22405, RT: 50.09, 強度: 153588, ログ強度: 1.72, アダクト: [M+HCOOH-H]-, [M-H2O-H]-, [M+CH3OH-H]-, 共有数（同様のピークを含むサンプル数）: 9

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	1.161	(4R,5S,7R,11x)-11,12-Dihydroxy-1(10)-spirovetiven-2-one 12-glucoside	HMDB: HMDB0030895, HMDB0302960
C21H34O8	414.22537	1.161	methyl 6,8-epidioxy-5,15-dihydroperoxy-9,11,13-eicosatrienoate	LipidMAPS: LMFA03050014
C21H34O8	414.22537	1.161	methyl 5-hydroperoxy-6,8,9,11-bisepidioxy-12,14-eicosadienoate	LipidMAPS: LMFA01040061
C21H34O8	414.22537	1.161	Dictamnoside L	KNApSAcK: C00045849
C21H34O8	414.22537	1.161	methyl 9,11-epidioxy-12,15-dihydroperoxy-5,7,13-eicosatrienoate	LipidMAPS: LMFA03050013
C21H34O8	414.22537	1.161	(4R,5S,7R,11S)-11,12-Dihydroxy-1(10)-spirovetiven-2-one 11-glucoside	HMDB: HMDB0033150
C21H34O8	414.22537	1.161	Dendromoniliside A	KNApSAcK: C00044701
C22H30O4N4	414.22671	-2.067	Distigmine	KEGG: [2]C16823
C22H30O4N4	414.22671	-2.067	Tentoxin	KEGG: C08441 KNApSAcK: C00001521

MSnスペクトル情報

Level: 2, プリカーサーm/z: 459.22403

Splash: splash10-03di-0001900000-dead02930524eeef3496

m/z	Int.	NL	Rel.Int.
413.14	8119	46	1000
417.33	1124	42	138
399.29	705	60	86
353.28	615	106	75

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
	49.70	501.19844	41.9744	-0.39	[M+2(HCOOH)-H2O-H]-	(23 names) Carolenalin 4-O-beta-D-glucoside; Cichorioside M; (+)-Cichorioside M; Ixerin E; Mukaadial 6-O-beta-D-glucopyranoside; Cichorioside N; (+)-Cichorioside N; Taraxacolide 1-O-b-D-glucopyranoside; Cuminoside B; (-)...	ALL 16 KN 14 HM 1 LM 1		7
	49.73	491.16963	31.9456	0.15	[M+HCOOH+HCl-H2O-H]-	(23 names) Carolenalin 4-O-beta-D-glucoside; Cichorioside M; (+)-Cichorioside M; Ixerin E; Mukaadial 6-O-beta-D-glucopyranoside; Cichorioside N; (+)-Cichorioside N; Taraxacolide 1-O-b-D-glucopyranoside; Cuminoside B; (-)...	ALL 16 KN 14 HM 1 LM 1		4
9510	50.09	459.22405	0.0000	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
	49.72	455.19288	-4.0312	0.99	[M+HCOOH-H2O-H]-	(23 names) Carolenalin 4-O-beta-D-glucoside; Cichorioside M; (+)-Cichorioside M; Ixerin E; Mukaadial 6-O-beta-D-glucopyranoside; Cichorioside N; (+)-Cichorioside N; Taraxacolide 1-O-b-D-glucopyranoside; Cuminoside B; (-)...	ALL 16 KN 14 HM 1 LM 1		10
	49.84	430.24513	-28.9789	-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
	50.10	413.21848	-46.0056	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

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