ピーク情報

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neg

Peak #3992 MN MID: SE205_S02_M91

m/z: 179.03506, RT: 36.65, 強度: 21111, ログ強度: 0.86, アダクト: [M-H]-, 共有数（同様のピークを含むサンプル数）: 3

DB検索結果: (12 names) (E)-3-(2,3-Dihydroxyphenyl)-2-propenoic acid;Monomethyl phthalate;m-Hydroxyphenylpyruvic acid;Cordytropolone;Caffeic acid;2-Hydroxy-3-(4-hydroxyphenyl)propenoic acid;Aspirin;cis-2,4-Dihydroxycinnamic ...

DBごとのヒット数: ALL 12 KG 5 KN 4 HM 3

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
C9H8O4	180.04226	0.453	trans-2,3-Dihydroxycinnamate	HMDB: HMDB0032057 KEGG: C12623
C9H8O4	180.04226	0.453	Monomethyl phthalate	HMDB: HMDB0002130
C9H8O4	180.04226	0.453	m-Hydroxyphenylpyruvic acid	KNApSAcK: C00051598
C9H8O4	180.04226	0.453	Cordytropolone	KNApSAcK: C00015976
C9H8O4	180.04226	0.453	Caffeic acid	HMDB: HMDB0001964, HMDB0003501 KEGG: C01197, C01481 KNApSAcK: C00000615
C9H8O4	180.04226	0.453	2-Hydroxy-3-(4-hydroxyphenyl)propenoate	HMDB: HMDB0006915 KEGG: C05350
C9H8O4	180.04226	0.453	Aspirin	HMDB: HMDB0001879 KEGG: C01405, [f]C13400 KNApSAcK: C00054084
C9H8O4	180.04226	0.453	cis-2,4-Dihydroxycinnamic acid	KNApSAcK: C00038786
C9H8O4	180.04226	0.453	3,5-Dihydroxycinnamic acid	HMDB: HMDB0032131
C9H8O4	180.04226	0.453	5,7-Dihydroxy-4-methylphthalide	KNApSAcK: C00038282
C9H8O4	180.04226	0.453	3-Hydroxyphenylpyruvic acid	HMDB: HMDB0011663
C9H8O4	180.04226	0.453	3-(4-Hydroxyphenyl)pyruvate	HMDB: HMDB0000707 KEGG: C01179 KNApSAcK: C00007512, C00051851, C00052716

MSnスペクトル情報

Level: 2, プリカーサーm/z: 179.03502

Splash: splash10-0a4i-0900000000-614399f6096f4305e86e

m/z	Int.	NL	Rel.Int.
107.06	29904	72	1000
151.01	4291	28	143

ピーク情報

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MSnスペクトル情報

FlavonoidSearch結果