ピーク情報

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Peak #4025 MN MID: SE199_S21_M90

m/z: 348.27423, RT: 62.09, 強度: 52321, ログ強度: 1.32, アダクト: [M+NH4]+, 共有数（同様のピークを含むサンプル数）: 5

DB検索結果: (12 names) 2R-undecanoyloxy-3R-hydroxy-4-methylpentanoic acid methyl ester;5,8,12-Trihydroxy-9-octadecenoic acid;3R-undecanoyloxy-2R-hydroxy-4-methylpentanoic acid methyl ester;9,10,18-trihydroxy-12-octadecenoic...

DBごとのヒット数: ALL 12 KG 3 KN 1 LM 8

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
C18H34O5	330.24062	-0.669	3R-undecanoyloxy-2R-hydroxy-4-methylpentanoic acid methyl ester	LipidMAPS: LMFA07090107
C18H34O5	330.24062	-0.669	11,12,13-trihydroxy-9-octadecenoic acid	LipidMAPS: LMFA02000165
C18H34O5	330.24062	-0.669	9,10,13-TriHOME	HMDB: HMDB0004710 KEGG: C14835 LipidMAPS: LMFA02000168, LMFA02000330, LMFA02000331, LMFA02000332, LMFA02000333, LMFA02000334, LMFA02000335, LMFA02000336, LMFA02000337
C18H34O5	330.24062	-0.669	9,10-Dihydroxy-12,13-epoxyoctadecanoate	KEGG: C14837
C18H34O5	330.24062	-0.669		LipidMAPS: LMFA01050555
C18H34O5	330.24062	-0.669	(2S,3S,5R)-tetrahydro-3-hydroxy-5-[(1R)-1-hydroxyhexyl]-2-furanoctanoic acid	LipidMAPS: LMFA01150073
C18H34O5	330.24062	-0.669	2R-undecanoyloxy-3R-hydroxy-4-methylpentanoic acid methyl ester	LipidMAPS: LMFA07090110
C18H34O5	330.24062	-0.669	5,8,12-Trihydroxy-9-octadecenoic acid	HMDB: HMDB0030936 LipidMAPS: LMFA01050543, LMFA02000221
C18H34O5	330.24062	-0.669	9,10,18-trihydroxy-12-octadecenoic acid	LipidMAPS: LMFA02000222, LMFA02000223, LMFA02000317
C18H34O5	330.24062	-0.669	9,12,13-TriHOME	HMDB: HMDB0004708, HMDB0038555 KEGG: C14833 KNApSAcK: C00035037, C00041298 LipidMAPS: LMFA02000014, LMFA02000169, LMFA02000294, LMFA02000338, LMFA02000339, LMFA02000340, LMFA02000341, LMFA02000342, LMFA02000343
C18H34O5	330.24062	-0.669	Tianshic acid	KNApSAcK: C00032358
C18H34O5	330.24062	-0.669	8R,9R,10S-trihydroxy-6Z-octadecenoic acid	LipidMAPS: LMFA02000363
C18H34O5	330.24062	-0.669	9S,10S,11R-trihydroxy-12Z-octadecenoic acid	LipidMAPS: LMFA02000011

MSnスペクトル情報

Level: 2, プリカーサーm/z: 348.27383

Splash: splash10-00di-0922000000-c4937a6e83ab88f38b95

m/z	Int.	NL	Rel.Int.
172.87	997	175	1000
295.18	389	53	390
155.00	290	193	290
313.22	180	35	180
312.44	120	36	120
330.24	91	18	90

Level: 3, プリカーサーm/z: 172.86655

Splash: splash10-0a4i-0900000000-2f52325e3b412d0ca53f

m/z	Int.	NL	Rel.Int.
155.02	6	18	1000
131.05	1	42	189

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
	62.11	353.22975	4.9555	0.45	[M+Na]+	(12 names) 2R-undecanoyloxy-3R-hydroxy-4-methylpentanoic acid methyl ester; 5,8,12-Trihydroxy-9-octadecenoic acid; 3R-undecanoyloxy-2R-hydroxy-4-methylpentanoic acid methyl ester; 9,10,18-trihydroxy-12-octadecenoic...	ALL 12 KG 3 KN 1 LM 8	MS2 MS3	0.083	0.034	2
4025	62.09	348.27423	0.0000	1.32	[M+NH4]+	(12 names) 2R-undecanoyloxy-3R-hydroxy-4-methylpentanoic acid methyl ester; 5,8,12-Trihydroxy-9-octadecenoic acid; 3R-undecanoyloxy-2R-hydroxy-4-methylpentanoic acid methyl ester; 9,10,18-trihydroxy-12-octadecenoic...	ALL 12 KG 3 KN 1 LM 8	MS2 MS3			5

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MSnスペクトル情報

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