ピーク情報

ミヤコグサ

pos

Peak #653 MN MID: SE205_S07_M90

m/z: 195.08631, RT: 11.97, 強度: 10916, ログ強度: 0.54, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 2

DB検索結果: (11 names) (2R,3R,5S)-1,2,3,5,6-Pentahydroxyheptan-4-one;1-Deoxy-D-manno-heptulose;Mytilitol;3-O-Methyl-D-fructose;3-O-Methyl-D-glucopyranose;Ononitol;Methyl beta-D-fructofuranoside;(-)-Methyl beta-D-fructofuran...

DBごとのヒット数: ALL 10 KG 2 KN 1 HM 7

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
C7H14O6	194.07904	-0.024	(2R,3R,5S)-1,2,3,5,6-Pentahydroxyheptan-4-one	HMDB: HMDB0255312
C7H14O6	194.07904	-0.024	1-Deoxy-D-manno-heptulose	HMDB: HMDB0243861
C7H14O6	194.07904	-0.024	Mytilitol	HMDB: HMDB0033816
C7H14O6	194.07904	-0.024	3-O-Methyl-D-fructose	HMDB: HMDB0245957
C7H14O6	194.07904	-0.024	3-O-Methyl-D-glucopyranose	HMDB: HMDB0245958
C7H14O6	194.07904	-0.024	(-)-Quebrachitol	HMDB: HMDB0029915, HMDB0031437, HMDB0031449, HMDB0034219, HMDB0034221, HMDB0062564, HMDB0304321 KEGG: C08257, C03844, C06352, C03365, C05163, C03659, C03660, C06353 KNApSAcK: C00001157, C00001166, C00001168, C00001169, C00001172, C00040932, C00048928
C7H14O6	194.07904	-0.024	Methyl beta-D-fructofuranoside	KNApSAcK: C00042736
C7H14O6	194.07904	-0.024	Methyl beta-D-galactoside	HMDB: HMDB0029965, HMDB0246173 KEGG: C03619 KNApSAcK: C00051554
C7H14O6	194.07904	-0.024	3-O-Methyl-d-glucose	HMDB: HMDB0245931
C8H18OS2	194.07991	-4.502	3-[(2-Mercapto-1-methylpropyl)thio]-2-butanol	HMDB: HMDB0037295

MSnスペクトル情報

Level: 2, プリカーサーm/z: 195.08607

Splash: splash10-004i-0900000000-e3264a92b04508a35ecd

m/z	Int.	NL	Rel.Int.
176.70	13903	18	1000
108.93	8695	86	625
126.94	7260	68	522
141.02	6939	54	499
144.83	1851	50	133
126.33	1810	69	130
158.92	1451	36	104
80.88	1302	114	93
137.93	865	57	62
140.38	850	55	61

Level: 3, プリカーサーm/z: 108.92691

Splash: splash10-001i-9000000000-c928abaea92807410f72

m/z	Int.	NL	Rel.Int.
80.84	2468	28	1000

Level: 3, プリカーサーm/z: 176.69830

Splash: splash10-0002-0900000000-7c48f357bcef967610ef

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

FlavonoidSearch結果

m/z	Int.	NL	Rel.Int.
145.03	345	32	1000
149.00	52	28	151
158.12	48	19	137
108.94	39	68	112
159.10	35	18	100