ピーク情報

パセリ　根

neg

Peak #8277 MN MID: SE61_S24_M91

m/z: 417.19178, RT: 87.68, 強度: 32662, ログ強度: 1.10, 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: (32 names) Kuhistanicaol I;(+)-Kuhistanicaol I;Polysyphorin;Norcaesalpinin C;(-)-Norcaesalpinin C;Artelinate;Methyl 11,17,21-trihydroxy-3,20-dioxopregna-1,4-diene-16-carboxylate;Caesalpinin F;(+)-Caesalpinin F;S...

DBごとのヒット数: ALL 24 KG 2 KN 16 HM 6

FlavonoidSearch最大スコア MS2: -, MS3: -

DB検索結果

ppm

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
C23H30O7	418.19915	-0.220	Kuhistanicaol I	KNApSAcK: C00037404
C23H30O7	418.19915	-0.220	Artelinate	HMDB: HMDB0248619
C23H30O7	418.19915	-0.220	Polysyphorin	KNApSAcK: C00046323
C23H30O7	418.19915	-0.220	Norcaesalpinin C	KNApSAcK: C00042790
C23H30O7	418.19915	-0.220	Methyl 11,17,21-trihydroxy-3,20-dioxopregna-1,4-diene-16-carboxylate	HMDB: HMDB0254561
C23H30O7	418.19915	-0.220	Caesalpinin F	KNApSAcK: C00042327
C23H30O7	418.19915	-0.220	Sequoiamonascin A	KNApSAcK: C00053780, C00053781
C23H30O7	418.19915	-0.220	Rhaphidecursinol A	KNApSAcK: C00046356
C23H30O7	418.19915	-0.220	(1a,5b,6a)-7-Protoilludene-1,5,6,14-tetrol 14-(2,4-dihydroxy-6-methylbenzoic acid)	HMDB: HMDB0031368
C23H30O7	418.19915	-0.220	Biondinin E	KEGG: C17852
C23H30O7	418.19915	-0.220	(+)-Bisabosqual D	KNApSAcK: C00015990
C23H30O7	418.19915	-0.220	Norcaesalpinin A	KNApSAcK: C00042788
C23H30O7	418.19915	-0.220	Judeol	HMDB: HMDB0034607
C23H30O7	418.19915	-0.220	Sarglaperoxide B	KNApSAcK: C00053768
C23H30O7	418.19915	-0.220	13-Hydroxydihydromelleolide	HMDB: HMDB0036929 KNApSAcK: C00021467
C23H30O7	418.19915	-0.220	Norcaesalpinin MA	KNApSAcK: C00043780
C23H30O7	418.19915	-0.220	Asteltoxin	HMDB: HMDB0029464 KNApSAcK: C00054807
C23H30O7	418.19915	-0.220	Melleolide E	HMDB: HMDB0038785
C23H30O7	418.19915	-0.220	Gomisin H	KEGG: C17820
C23H30O7	418.19915	-0.220	Norcaesalpinin B	KNApSAcK: C00042789
C23H30O7	418.19915	-0.220	Acanthoglabrolide	KNApSAcK: C00011854
C23H30O7	418.19915	-0.220	Rhaphidecursinol B	HMDB: HMDB0030828 KNApSAcK: C00046357, C00054634
C23H30O7	418.19915	-0.220	Diosbulbin H	HMDB: HMDB0036781
C23H30O7	418.19915	-0.220	Sequoiamonascin C	KNApSAcK: C00053782

MSnスペクトル情報

Level: 2, プリカーサーm/z: 417.19186

Splash: splash10-0002-0097000000-e00b2f7a1d5270c9b995

m/z	Int.	NL	Rel.Int.
297.29	952	120	1000
299.24	678	118	711
355.21	366	62	384
399.15	321	18	336
373.24	206	44	216
357.21	174	60	182
325.26	92	92	96
313.34	86	104	89
311.17	64	106	67

Level: 3, プリカーサーm/z: 297.18683

Splash: splash10-03di-0090000000-0ba5d89d21358b23959f

m/z	Int.	NL	Rel.Int.
212.09	85	85	1000
269.29	42	28	495
211.21	13	86	149
297.35	11	-0	129
137.83	7	159	79
158.89	6	138	75
226.21	5	71	55

Level: 3, プリカーサーm/z: 299.28775

Splash: splash10-05ai-0590000000-0d1eac22029b945f749b

m/z	Int.	NL	Rel.Int.
281.23	69	18	1000
255.36	57	44	824
271.25	32	28	458
147.05	29	152	420
253.15	22	46	324
173.02	17	126	241
183.98	14	115	202
187.04	8	112	119
165.19	8	134	111
158.18	7	141	102
193.27	6	106	91
169.00	6	130	91
185.25	5	114	76
189.17	4	110	52

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
	87.68	463.19731	46.0055	1.13	[M+HCOOH-H]-	(32 names) Kuhistanicaol I; (+)-Kuhistanicaol I; Polysyphorin; Norcaesalpinin C; (-)-Norcaesalpinin C; Artelinate; Methyl 11,17,21-trihydroxy-3,20-dioxopregna-1,4-diene-16-carboxylate; Caesalpinin F; (+)-Caesalpinin F; S...	ALL 24 KG 2 KN 16 HM 6		1
	87.67	453.16834	35.9766	1.44	[M+HCl-H]-	(32 names) Kuhistanicaol I; (+)-Kuhistanicaol I; Polysyphorin; Norcaesalpinin C; (-)-Norcaesalpinin C; Artelinate; Methyl 11,17,21-trihydroxy-3,20-dioxopregna-1,4-diene-16-carboxylate; Caesalpinin F; (+)-Caesalpinin F; S...	ALL 24 KG 2 KN 16 HM 6	MS2 MS3 x 2	1
8277	87.68	417.19178	0.0000	1.10	[M-H]-	(32 names) Kuhistanicaol I; (+)-Kuhistanicaol I; Polysyphorin; Norcaesalpinin C; (-)-Norcaesalpinin C; Artelinate; Methyl 11,17,21-trihydroxy-3,20-dioxopregna-1,4-diene-16-carboxylate; Caesalpinin F; (+)-Caesalpinin F; S...	ALL 24 KG 2 KN 16 HM 6	MS2 MS3 x 2	1
	87.68	399.18130	-18.0105	0.27	[M-H2O-H]-	(32 names) Kuhistanicaol I; (+)-Kuhistanicaol I; Polysyphorin; Norcaesalpinin C; (-)-Norcaesalpinin C; Artelinate; Methyl 11,17,21-trihydroxy-3,20-dioxopregna-1,4-diene-16-carboxylate; Caesalpinin F; (+)-Caesalpinin F; S...	ALL 24 KG 2 KN 16 HM 6	MS2	1

ピーク情報

DB検索結果

MSnスペクトル情報

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