ピーク情報

トマト Micro-Tom 花

pos

Peak #1010 MN MID: SE203_S31_M90

m/z: 504.19205, RT: 12.21, 強度: 26086, ログ強度: 0.76, アダクト: [M+CH3OH-H2O+H]+, [M+NH4]+, 共有数（同様のピークを含むサンプル数）: 26

DB検索結果: (2S)-3-[3-[(4-Carbamimidoylbenzoyl)amino]propanoylamino]-2-[(4-ethylphenyl)sulfonylamino]propanoic acid

DBごとのヒット数: ALL 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
C22H27O6N5S	489.16820	1.885	(2S)-3-[3-[(4-Carbamimidoylbenzoyl)amino]propanoylamino]-2-[(4-ethylphenyl)sulfonylamino]propanoic acid	HMDB: HMDB0258340

Level: 2, プリカーサーm/z: 504.19183

Splash: splash10-03di-0900000000-5fa8db9c4290c4b2ebc2

m/z	Int.	NL	Rel.Int.
161.97	2851	342	1000
144.06	189	360	66
325.05	171	179	59

Level: 3, プリカーサーm/z: 161.99109

Splash: splash10-0006-0900000000-e13ff42616ca9783d5ad

m/z	Int.	NL	Rel.Int.
143.94	847	18	1000
115.97	333	46	393

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
	12.05	525.12151	20.9295	0.76	[M-H2O+K]+, [M+K]+	(32 names) Galactotriose; ; 1-Kestose; Panose; 4-alpha-Isomaltosylglucose; Maltotriose; alpha-D-Glucopyranosyl-(1->6)-alpha-D-glucopyranosyl-(1->2)-D-glucose; 3-beta-Gentiobiosylglucose; O-alpha-D-Mannopyranosyl-(1-4)-O...	ALL 31 KG 15 KN 3 HM 13	MS2	23
	12.02	522.20289	18.0108	0.70	[M+CH3OH+H]+, [M+NH4]+	(2S)-3-[3-[(4-Carbamimidoylbenzoyl)amino]propanoylamino]-2-[(4-ethylphenyl)sulfonylamino]propanoic acid	ALL 1 HM 1		26
1010	12.21	504.19205	0.0000	0.76	[M+CH3OH-H2O+H]+, [M+NH4]+	(2S)-3-[3-[(4-Carbamimidoylbenzoyl)amino]propanoylamino]-2-[(4-ethylphenyl)sulfonylamino]propanoic acid	ALL 1 HM 1	MS2 MS3	26
	11.88	490.17625	-14.0158	1.98	[M+H]+	(2S)-3-[3-[(4-Carbamimidoylbenzoyl)amino]propanoylamino]-2-[(4-ethylphenyl)sulfonylamino]propanoic acid	ALL 1 HM 1	MS2 MS3	22
	12.05	487.16550	-17.0266	0.59	[M-H2O+H]+, [M+H]+, [M+CH3OH+2H]2+	(32 names) Galactotriose; ; 1-Kestose; Panose; 4-alpha-Isomaltosylglucose; Maltotriose; alpha-D-Glucopyranosyl-(1->6)-alpha-D-glucopyranosyl-(1->2)-D-glucose; 3-beta-Gentiobiosylglucose; O-alpha-D-Mannopyranosyl-(1-4)-O...	ALL 31 KG 15 KN 3 HM 13		27