ピーク情報

リーフレタスグリーン

neg

Peak #2996 MN MID: SE198_S12_M91

m/z: 179.03466, RT: 33.91, 強度: 21406, ログ強度: 0.90, 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: (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	-1.785	trans-2,3-Dihydroxycinnamate	HMDB: HMDB0032057 KEGG: C12623
C9H8O4	180.04226	-1.785	Monomethyl phthalate	HMDB: HMDB0002130
C9H8O4	180.04226	-1.785	m-Hydroxyphenylpyruvic acid	KNApSAcK: C00051598
C9H8O4	180.04226	-1.785	Cordytropolone	KNApSAcK: C00015976
C9H8O4	180.04226	-1.785	Caffeic acid	HMDB: HMDB0001964, HMDB0003501 KEGG: C01197, C01481 KNApSAcK: C00000615
C9H8O4	180.04226	-1.785	2-Hydroxy-3-(4-hydroxyphenyl)propenoate	HMDB: HMDB0006915 KEGG: C05350
C9H8O4	180.04226	-1.785	Aspirin	HMDB: HMDB0001879 KEGG: C01405, [f]C13400 KNApSAcK: C00054084
C9H8O4	180.04226	-1.785	cis-2,4-Dihydroxycinnamic acid	KNApSAcK: C00038786
C9H8O4	180.04226	-1.785	3,5-Dihydroxycinnamic acid	HMDB: HMDB0032131
C9H8O4	180.04226	-1.785	5,7-Dihydroxy-4-methylphthalide	KNApSAcK: C00038282
C9H8O4	180.04226	-1.785	3-Hydroxyphenylpyruvic acid	HMDB: HMDB0011663
C9H8O4	180.04226	-1.785	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: 179.03503

Splash: splash10-001i-0900000000-57ac15edf4d13f658c22

m/z	Int.	NL	Rel.Int.
134.96	302009	44	1000

Level: 3, プリカーサーm/z: 134.95912

Splash: splash10-0563-8900000000-7f564cadeb741cd6c3b1

m/z	Int.	NL	Rel.Int.
134.92	43	0	1000
90.83	39	44	917
78.96	39	56	903
106.88	35	28	823

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果