ピーク情報

（えんどう類）トウミョウ茎葉生

pos

Peak #2105 MN MID: SE118_S060191_M90

m/z: 188.07052, RT: 33.17, 強度: 5760, ログ強度: 0.45, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 125

DB検索結果: (4 names) N-Methylquinolinium-2-carboxylate;N-(2,5-Dihydroxyphenyl)pyridinium(1+);Indoleacrylic acid;Deethylatrazine

DBごとのヒット数: ALL 5 KG 3 KN 1 HM 1

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
C11H9O2N	187.06333	-0.445	Quinacetol sulfate	KEGG: [f]C18944
C11H9O2N	187.06333	-0.445	N-(2,5-Dihydroxyphenyl)pyridinium(1+)	HMDB: [1]HMDB0040768
C11H9O2N	187.06333	-0.445	N-Methylquinolinium-2-carboxylate	KNApSAcK: C00026467
C11H9O2N	187.06333	-0.445	3-Indoleacrylate	HMDB: HMDB0000734 KEGG: C21283 KNApSAcK: C00000111
C6H10N5Cl	187.06247	4.126	Deethylatrazine	HMDB: HMDB0033249 KEGG: C06559

Level: 2, プリカーサーm/z: 188.07043

Splash: splash10-0002-0900000000-6af4e5373bf8874dcd86

m/z	Int.	NL	Rel.Int.
145.97	356394	42	1000
144.00	35636	44	99

Level: 3, プリカーサーm/z: 145.96922

Splash: splash10-014i-0900000000-435c4be879ac61f4c24b

m/z	Int.	NL	Rel.Int.
117.94	112985	28	1000

Level: 3, プリカーサーm/z: 143.99799

Splash: splash10-014i-0900000000-3c25bb5c57497dba0a29

m/z	Int.	NL	Rel.Int.
116.93	86	27	1000
126.88	42	17	493

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
	33.20	246.12368	58.0532	0.91	[M+C2H6N2+H]+, [M+ACN+NH4]+	(5 names) N-Methylquinolinium-2-carboxylate; N-(2,5-Dihydroxyphenyl)pyridinium(1+); Indoleacrylic acid; Deethylatrazine; 6-Fluoropyridoxol	ALL 6 KG 3 KN 1 HM 2	MS2 MS3	136
	33.21	205.09709	17.0266	2.17	[M+NH4]+	(4 names) N-Methylquinolinium-2-carboxylate; N-(2,5-Dihydroxyphenyl)pyridinium(1+); Indoleacrylic acid; Deethylatrazine	ALL 5 KG 3 KN 1 HM 1	MS2 MS3	200
2105	33.17	188.07052	0.0000	0.45	[M+H]+	(4 names) N-Methylquinolinium-2-carboxylate; N-(2,5-Dihydroxyphenyl)pyridinium(1+); Indoleacrylic acid; Deethylatrazine	ALL 5 KG 3 KN 1 HM 1	MS2 MS3 x 2	125