ピーク情報

＜アルコール飲料類＞（醸造酒類）清酒純米吟醸酒

neg

Peak #3585 MN MID: SE117_S160051_M91

m/z: 385.20936, RT: 34.93, 強度: 5648, ログ強度: 0.41, アダクト: [M+2(ACN)+2(HCOOH)-H2O-H]-, 共有数（同様のピークを含むサンプル数）: 3

DB検索結果: (4 names) Leucyl-Valine;Valylleucine;Isoleucyl-Valine;Valylisoleucine

DBごとのヒット数: ALL 4 HM 4

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
C11H22O3N2	230.16304	0.421	Leucyl-Valine	HMDB: HMDB0028942
C11H22O3N2	230.16304	0.421	Valylleucine	HMDB: HMDB0029131
C11H22O3N2	230.16304	0.421	Isoleucyl-Valine	HMDB: HMDB0028920
C11H22O3N2	230.16304	0.421	Valylisoleucine	HMDB: HMDB0029130

Level: 2, プリカーサーm/z: 385.20935

Splash: splash10-001i-0943000000-8ddc34a2d19da1f9052b

m/z	Int.	NL	Rel.Int.
182.14	1422	203	1000
181.08	934	204	656
270.21	820	115	576
355.31	464	30	326
240.11	261	145	183
341.23	214	44	150
227.18	191	158	134
367.31	170	18	119
152.08	154	233	108
252.17	144	133	101
311.35	120	74	84
114.06	90	271	62
163.99	85	221	59

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
	34.83	426.23587	41.0265	0.33	[M+3(ACN)+2(HCOOH)-H2O-H]-	(4 names) Leucyl-Valine; Valylleucine; Isoleucyl-Valine; Valylisoleucine	ALL 4 HM 4	MS2	3
3585	34.93	385.20936	0.0000	0.41	[M+2(ACN)+2(HCOOH)-H2O-H]-	(4 names) Leucyl-Valine; Valylleucine; Isoleucyl-Valine; Valylisoleucine	ALL 4 HM 4	MS2	3
	34.61	358.19859	-27.0108	0.42	[M+ACN+CH3OH+2(HCOOH)-2(H2O)-H]-	(4 names) Leucyl-Valine; Valylleucine; Isoleucyl-Valine; Valylisoleucine	ALL 4 HM 4	MS2	9
	35.17	357.21433	-27.9950	-0.21	[M+ACN+CH5N+2(HCOOH)-2(H2O)-H]-, [M+2(ACN)+HCOOH-H]-, [M+C2H7N+CH3OH-H2O-H]-	(4 names) Leucyl-Valine; Valylleucine; Isoleucyl-Valine; Valylisoleucine	ALL 4 HM 4		6
	35.13	343.19877	-42.0106	0.62	[M+ACN+2(HCOOH)+NH3-2(H2O)-H]-, [M+Na-2H]-, [M+C2H7N-H]-, [M+CH3OH+CH5N-H2O-H]-	(4 names) Leucyl-Valine; Valylleucine; Isoleucyl-Valine; Valylisoleucine	ALL 4 HM 4	MS2	13
	35.28	330.20349	-55.0059	0.52	[M+ACN+CH3OH+HCOOH-H2O-H]-, [M+ACN+HCOOH-H]-	(4 names) Leucyl-Valine; Valylleucine; Isoleucyl-Valine; Valylisoleucine	ALL 4 HM 4	MS2	7