ピーク情報

はつか大根　根

pos

Peak #1457 MN MID: SE202_S11_M90

m/z: 330.11816, RT: 12.41, 強度: 8420, ログ強度: 0.43, アダクト: [2M+ACN+H]+, 共有数（同様のピークを含むサンプル数）: 4

DB検索結果: (29 names) 3,6-Dimethyl-1,4-dioxane-2,5-dione;2-methylidenepentanedioic acid;2-Ethylbut-2-enedioic acid;2-Hydroxy-2-(hydroxymethyl)-2H-pyran-3(6H)-one;Microthecin;1,1-Cyclobutanedicarboxylic acid;2-Oxopropyl 2-o...

DBごとのヒット数: ALL 20 KG 7 KN 3 HM 6 LM 4

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
C6H8O4	144.04226	-0.621	3,6-Dimethyl-1,4-dioxane-2,5-dione	HMDB: HMDB0246077
C6H8O4	144.04226	-0.621	2-Ethylbut-2-enedioic acid	HMDB: HMDB0245118
C6H8O4	144.04226	-0.621	2-Methyleneglutarate	KEGG: C02930 LipidMAPS: LMFA01020394
C6H8O4	144.04226	-0.621	2-Hydroxy-2-(hydroxymethyl)-2H-pyran-3(6H)-one	KEGG: C19821
C6H8O4	144.04226	-0.621	1,1-Cyclobutanedicarboxylic acid	HMDB: HMDB0250639
C6H8O4	144.04226	-0.621	2-Oxopropyl 2-oxopropanoate	HMDB: HMDB0247914
C6H8O4	144.04226	-0.621	3-Methylglutaconic acid	HMDB: HMDB0000522 KNApSAcK: C00052150 LipidMAPS: LMFA01170068
C6H8O4	144.04226	-0.621	1,5-Anhydro-4-deoxy-D-glycero-hex-3-en-2-ulose	KEGG: C19822
C6H8O4	144.04226	-0.621	2,3-Dihydro-3,5-dihydroxy-6-methyl-4H-pyran-4-one	KNApSAcK: C00029432
C6H8O4	144.04226	-0.621	3-Hydroxyadipic acid 3,6-lactone	HMDB: HMDB0029171
C6H8O4	144.04226	-0.621	Methylitaconate	KEGG: C02295
C6H8O4	144.04226	-0.621	(E)-2-Methylglutaconic acid	HMDB: HMDB0002266 LipidMAPS: LMFA01170079
C6H8O4	144.04226	-0.621	(-)-Pentenomycin I	KNApSAcK: C00017967
C6H8O4	144.04226	-0.621	trans-2-Hexenedioic acid	HMDB: HMDB0013311 LipidMAPS: LMFA01170070
C6H8O4	144.04226	-0.621	1,5-Anhydro-4-deoxy-D-glycero-hex-1-en-3-ulose	KEGG: C19826
C6H8O4	144.04226	-0.621	Triacetate	HMDB: HMDB0259137 KEGG: C01757
C6H8O4	144.04226	-0.621	Dimethyl maleate	HMDB: HMDB0031257, HMDB0240744, HMDB0251383
C6H8O4	144.04226	-0.621	3-Hexenedioic acid	HMDB: HMDB0000393 LipidMAPS: LMFA01170087
C6H8O4	144.04226	-0.621	2,3-Dimethylmaleate	HMDB: HMDB0036232, HMDB0245400 KEGG: C00922
C6H8O4	144.04226	-0.621	Ethyl hydrogen fumarate	HMDB: HMDB0040207, HMDB0246416 LipidMAPS: LMFA07010876

MSnスペクトル情報

Level: 2, プリカーサーm/z: 330.11807

Splash: splash10-014i-0900000000-2a7cde0b6fb98c448e47

m/z	Int.	NL	Rel.Int.
167.95	9192	162	1000
149.95	4433	180	482

Level: 3, プリカーサーm/z: 167.94785

Splash: splash10-0002-0900000000-8ca397c0ff5ea7a6bf8e

m/z	Int.	NL	Rel.Int.
149.95	5195	18	1000

Level: 3, プリカーサーm/z: 149.96606

Splash: splash10-00di-2900000000-42fb624adf6c43651b92

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.
121.92	316	28	1000
93.93	129	56	409
105.97	125	44	394