ピーク情報

イチョウ　葉

pos

Peak #12078 MN MID: SE205_S01_M90

m/z: 561.37922, RT: 94.00, 強度: 353701, ログ強度: 2.00, アダクト: [M+2(CH3OH)-2(H2O)+H]+, 共有数（同様のピークを含むサンプル数）: 2

DB検索結果: (4 names) (5Z,7E)-(1S,3R)-22-oxa-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol 3-hemiglutarate;Quadrangularic acid G;(+)-Quadrangularic acid G;3beta,6beta,19alpha-trihydroxy-urs-12-en-28-oic acid-24-carboxyl...

DBごとのヒット数: ALL 3 KN 1 LM 2

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
C31H48O7	532.34000	1.196	(5Z,7E)-(1S,3R)-22-oxa-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol 3-hemiglutarate	LipidMAPS: LMST03020492
C31H48O7	532.34000	1.196	2beta,3beta-diacetoxy-15alpha,22R-dihydroxy-5alpha-cholest-7-en-6-one	LipidMAPS: LMST01010617
C31H48O7	532.34000	1.196	Quadrangularic acid G	KNApSAcK: C00046573, C00046870
C31H48O7	532.34000	1.196	3beta,6beta,19alpha-trihydroxy-urs-12-en-28-oic acid-24-carboxylic acid methyl ester	LipidMAPS: LMPR0106180021

MSnスペクトル情報

Level: 2, プリカーサーm/z: 561.37860

Splash: splash10-0006-0000090000-d2124161fe0b78357860

m/z	Int.	NL	Rel.Int.
543.48	24351	18	1000
525.45	3306	36	135
283.19	1307	278	53

Level: 3, プリカーサーm/z: 543.39368

Splash: splash10-004i-0010970000-7c6c4eae1f02dd52ec1e

m/z	Int.	NL	Rel.Int.
525.39	4247	18	1000
469.39	1429	74	336
451.36	1389	92	327
487.47	1261	56	296
433.46	917	110	216
299.28	345	244	81
415.33	248	128	58
227.06	242	316	56
357.27	215	186	50

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	FS2	FS3	共有数
12078	94.00	561.37922	0.0000	2.00	[M+2(CH3OH)-2(H2O)+H]+	(4 names) (5Z,7E)-(1S,3R)-22-oxa-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol 3-hemiglutarate; Quadrangularic acid G; (+)-Quadrangularic acid G; 3beta,6beta,19alpha-trihydroxy-urs-12-en-28-oic acid-24-carboxyl...	ALL 3 KN 1 LM 2	MS2 MS3			2
	93.97	543.36847	-18.0107	1.88	[M+2(CH3OH)-3(H2O)+H]+	(4 names) (5Z,7E)-(1S,3R)-22-oxa-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol 3-hemiglutarate; Quadrangularic acid G; (+)-Quadrangularic acid G; 3beta,6beta,19alpha-trihydroxy-urs-12-en-28-oic acid-24-carboxyl...	ALL 3 KN 1 LM 2	MS2 MS3			3

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

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