ピーク情報

パセリ　根

neg

Peak #8285 MN MID: SE61_S24_M91

m/z: 175.02434, RT: 87.69, 強度: 6624, ログ強度: 0.41, アダクト: [M-H]-, 共有数（同様のピークを含むサンプル数）: 1

DB検索結果: (22 names) D-Galacturonolactone;D-gamma-Galacturonolactone;(4S)-4,6-dihydroxy-2,5-dioxohexanoic acid;3-deoxy-D-glycero-hexo-2,5-diulosonic acid;(4S,5S)-4,5-Dihydroxy-2,6-dioxohexanoate;(R)-2-((S)-1,2-Dihydroxyet...

DBごとのヒット数: ALL 18 KG 11 HM 7

FlavonoidSearch最大スコア MS2: -, MS3: -

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
C6H8O6	176.03209	-2.671	D-Glucuronolactone	HMDB: HMDB0242712 KEGG: C02670, C06430
C6H8O6	176.03209	-2.671	(4S)-4,6-Dihydroxy-2,5-dioxohexanoate	KEGG: C04349 LipidMAPS: LMFA01050490
C6H8O6	176.03209	-2.671	(4S,5S)-4,5-Dihydroxy-2,6-dioxohexanoate	KEGG: C04471, C04053 LipidMAPS: LMFA01050449
C6H8O6	176.03209	-2.671	(R)-2-((S)-1,2-Dihydroxyethyl)-4,5-dihydroxyfuran-3(2H)-one	HMDB: HMDB0248912
C6H8O6	176.03209	-2.671	Choline ascorbate	HMDB: [-1f]HMDB0302256
C6H8O6	176.03209	-2.671	Propane-1,2,3-tricarboxylate	HMDB: HMDB0031193 KEGG: C19806 KNApSAcK: C00054029
C6H8O6	176.03209	-2.671	Diglyceride	HMDB: HMDB0251280
C6H8O6	176.03209	-2.671	Ascorbate	HMDB: HMDB0000044, HMDB0248647, [f]HMDB0303656, [f]HMDB0303702, [f]HMDB0303717, [f]HMDB0304830 KEGG: C00072, C20364 KNApSAcK: C00001179, C00050430, [-1]C00055722
C6H8O6	176.03209	-2.671	L-xylo-Hexulonolactone	HMDB: HMDB0246713 KEGG: C03289
C6H8O6	176.03209	-2.671	D-Glucurono-6,2-lactone	KEGG: C03387
C6H8O6	176.03209	-2.671	2-Dehydro-D-glucono-1,5-lactone	KEGG: C06440
C6H8O6	176.03209	-2.671	2-Hydroxy-3-oxoadipate	KEGG: C03217 LipidMAPS: LMFA01050479
C6H8O6	176.03209	-2.671	4-Deoxy-L-threo-hex-4-enopyranuronate	KEGG: C22712, C22713
C6H8O6	176.03209	-2.671	(3S,4R,5S)-3,4-Dihydroxy-5-(2-hydroxyacetyl)oxolan-2-one	HMDB: HMDB0255328
C6H8O6	176.03209	-2.671	D-Glucurono-6,3-lactone	HMDB: HMDB0006355
C6H8O6	176.03209	-2.671	(5R)-5-(1,2-Dihydroxyethyl)-3-hydroxyoxolane-2,4-dione	HMDB: HMDB0260162
C6H8O6	176.03209	-2.671	3-Dehydro-scyllo-inosose	KEGG: C21643
C6H8O6	176.03209	-2.671	2-Hydroxy-5-oxohexanedioic acid	HMDB: HMDB0257585
C6H8O6	176.03209	-2.671	Parapyruvate	KEGG: C06033

MSnスペクトル情報

Level: 2, プリカーサーm/z: 175.02438

Splash: splash10-03di-0900000000-e8ecbdb746f197c24743

m/z	Int.	NL	Rel.Int.
114.97	57435	60	1000
70.96	4276	104	74
112.86	3452	62	60

Level: 3, プリカーサーm/z: 114.89819

Splash: splash10-052r-9000000000-879936db689a14a16f04

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

m/z	Int.	NL	Rel.Int.
86.92	2554	28	1000
58.89	2531	56	990