ピーク情報

リーフレタスグリーン

pos

Peak #816 MN MID: SE198_S12_M90

m/z: 525.12202, RT: 13.06, 強度: 40920, ログ強度: 1.12, アダクト: [M-H2O+K]+, [M+K]+, 共有数（同様のピークを含むサンプル数）: 12

DB検索結果: (33 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...

DBごとのヒット数: ALL 32 KG 15 KN 3 HM 14

FlavonoidSearch最大スコア MS2: -, MS3: -

安定同位体ラベル実験で見積もられた原子数:

N: 0

S: 0

DB検索結果

ppm

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
C18H32O16	504.16903	0.779	1,3-beta-D-Oligoglucan	HMDB: HMDB0029922 KEGG: C03200, C00771, C07283
C18H32O16	504.16903	0.779	Galactogen	KEGG: C01698
C18H32O16	504.16903	0.779	1-Kestose	HMDB: HMDB0011729 KEGG: C03661 KNApSAcK: C00048937
C18H32O16	504.16903	0.779	Panose	KNApSAcK: C00050489
C18H32O16	504.16903	0.779	Maltotriose	HMDB: HMDB0246628 KNApSAcK: C00055979
C18H32O16	504.16903	0.779	alpha-D-Glucopyranosyl-(1->6)-alpha-D-glucopyranosyl-(1->2)-D-glucose	HMDB: HMDB0039704
C18H32O16	504.16903	0.779	3-beta-Gentiobiosylglucose	HMDB: HMDB0039703
C18H32O16	504.16903	0.779	O-alpha-D-Mannopyranosyl-(1-4)-O-alpha-D-mannopyranosyl-(1-4)-alpha-D-mannopyranose	HMDB: HMDB0247818
C18H32O16	504.16903	0.779	beta-D-Galactopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->6)-D-galactose	HMDB: HMDB0038853
C18H32O16	504.16903	0.779	Umbelliferose	HMDB: HMDB0033748 KEGG: C08251 KNApSAcK: C00001153
C18H32O16	504.16903	0.779	Planteose	HMDB: HMDB0302793 KEGG: C03848 KNApSAcK: C00001144
C18H32O16	504.16903	0.779	1,2-beta-Oligomannan	HMDB: HMDB0040984 KEGG: C21335, C21454
C18H32O16	504.16903	0.779	Levan	HMDB: HMDB0003539
C18H32O16	504.16903	0.779	Melezitose	HMDB: HMDB0011730 KEGG: C08243 KNApSAcK: C00001141
C18H32O16	504.16903	0.779	beta-D-Fructofuranosyl alpha-D-glucopyranosyl-(1->4)-D-glucopyranoside	HMDB: HMDB0029930
C18H32O16	504.16903	0.779	beta-D-Galactopyranosyl-(1->2)-[beta-D-galactopyranosyl-(1->4)]-D-galactose	HMDB: HMDB0038851
C18H32O16	504.16903	0.779	3-Galactosyllactose	HMDB: HMDB0006599, HMDB0039706, HMDB0246251
C18H32O16	504.16903	0.779	Raffinose	HMDB: HMDB0003213, HMDB0034072 KEGG: C08239, C00492 KNApSAcK: C00001135, C00001145
C18H32O16	504.16903	0.779	3-beta-Cellobiosylglucose	HMDB: HMDB0039708
C18H32O16	504.16903	0.779	6-Kestose	HMDB: HMDB0033673
C18H32O16	504.16903	0.779	6-alpha-Maltosylglucose	HMDB: HMDB0039707 KEGG: C03367, C04417
C18H32O16	504.16903	0.779	Neokestose	HMDB: HMDB0029921
C18H32O16	504.16903	0.779	1-alpha-D-[(1->4)-alpha-D-Glucosyl](n-1)-alpha-D-glucopyranoside	KEGG: C06400
C18H32O16	504.16903	0.779	Manninotriose	HMDB: HMDB0041948, HMDB0247628 KNApSAcK: C00050475, C00051462
C18H32O16	504.16903	0.779	Galactomannan	HMDB: HMDB0029929 KEGG: C00883
C18H32O16	504.16903	0.779	Levan	HMDB: HMDB0254045 KEGG: C06215
C18H32O16	504.16903	0.779	Polysaccharide	HMDB: HMDB0001262, HMDB0006857, HMDB0038852 KEGG: C00420, C01835, C01935, C01898, C06219, C17207
C18H32O16	504.16903	0.779	Panose	HMDB: HMDB0029937 KEGG: C00713
C18H32O16	504.16903	0.779	P(k) Trisaccharide	HMDB: HMDB0242554
C18H32O16	504.16903	0.779	Isomaltotriose	HMDB: HMDB0029910, HMDB0060468 KEGG: C02160, C02493, C05404
C18H32O16	504.16903	0.779	Fagopyritol B2	HMDB: HMDB0035322, HMDB0040181
C28H28O5N2S	504.17189	-4.890	4-Cyano-N-(3-(cyclopropyl(5,6,7,8,9,10-hexahydro-4-hydroxy-2-oxo-2H-cycloocta(b)pyran-3-yl)methyl)phenyl)benzenesulfonamide	HMDB: HMDB0256657

MSnスペクトル情報

Level: 2, プリカーサーm/z: 525.12140

Splash: splash10-03di-0009000000-f51ad4f9989bf89626ee

m/z	Int.	NL	Rel.Int.
363.15	4063	162	1000

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	FS3	N原子数	S原子数	共有数
	13.47	543.13210	18.0101	2.65	[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 MS3 x 2		N 0	S 0	9
816	13.06	525.12202	0.0000	1.12	[M-H2O+K]+, [M+K]+	(33 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 32 KG 15 KN 3 HM 14	MS2		N 0	S 0	12
	13.51	522.20292	-2.9191	2.26	[M+NH4]+, [M+CH3OH+H]+	(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 MS3	0.091	N 0	S 0	7
	13.13	504.19240	-20.9296	1.22	[M+CH3OH-H2O+H]+, [M+NH4]+	(2S)-3-[3-[(4-Carbamimidoylbenzoyl)amino]propanoylamino]-2-[(4-ethylphenyl)sulfonylamino]propanoic acid	ALL 1 HM 1	MS2		N 0	S 0	17
	13.05	487.16570	-37.9563	1.29	[M-H2O+H]+, [M+H]+	(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			N 0	S 0	9

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

関連ピーク情報