ピーク情報

リーフレタスグリーン

pos

Peak #10111 MN MID: SE198_S12_M90

m/z: 195.06531, RT: 56.54, 強度: 41486, ログ強度: 0.00, 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: (32 names) Speciosin D;(+)-Speciosin D;Silvaticol;Methyl 2-(4-methoxyphenyl)-2-oxoacetate;2,5-Dihydroxycinnamic acid methyl ester;Kakuol;Piperonyl acetate;Dimethyl phthalate;3-Deoxyisoochracinic acid;(-)-3-Deoxy...

DBごとのヒット数: ALL 28 KG 9 KN 10 HM 7 LM 2

FlavonoidSearch最大スコア MS2: -, MS3: -

安定同位体ラベル実験で見積もられた原子数:

N: 0

S: 0

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
C10H10O4	194.05791	0.663	Speciosin D	KNApSAcK: C00048137
C10H10O4	194.05791	0.663	Phenylsuccinate	KEGG: C22494
C10H10O4	194.05791	0.663	Silvaticol	KNApSAcK: C00045405
C10H10O4	194.05791	0.663	2,5-Dihydroxycinnamic acid methyl ester	HMDB: HMDB0061686
C10H10O4	194.05791	0.663	Methyl 2-(4-methoxyphenyl)-2-oxoacetate	KNApSAcK: C00046137
C10H10O4	194.05791	0.663	Kakuol	KEGG: C16982 KNApSAcK: C00051119
C10H10O4	194.05791	0.663	Piperonyl acetate	HMDB: HMDB0032614
C10H10O4	194.05791	0.663	Dimethyl phthalate	HMDB: HMDB0251388 KEGG: C11233
C10H10O4	194.05791	0.663	mono-Benzyl malonate	HMDB: HMDB0059721
C10H10O4	194.05791	0.663	3-Deoxyisoochracinic acid	KNApSAcK: C00045560
C10H10O4	194.05791	0.663	Isoferulic acid	HMDB: HMDB0000955, HMDB0259693 KEGG: C10470 KNApSAcK: C00002752
C10H10O4	194.05791	0.663	Ferulic acid	HMDB: HMDB0000954, HMDB0240705, [-1f]HMDB0303721 KEGG: C01494 KNApSAcK: C00002743, C00034325
C10H10O4	194.05791	0.663	2,4,8-Trihydroxy-1-tetralone	KEGG: C09974 KNApSAcK: C00003020
C10H10O4	194.05791	0.663	Vanillin acetate	HMDB: HMDB0029663
C10H10O4	194.05791	0.663	3-(2-Formyl-3-hydroxyphenyl)-propionic acid	KNApSAcK: C00045552
C10H10O4	194.05791	0.663	Deca-4,6,8-triyne-1,1,2,3-tetraol	LipidMAPS: LMFA05000711
C10H10O4	194.05791	0.663	4-(2-Hydroxyphenyl)-4-oxobutyric acid	KNApSAcK: C00034393
C10H10O4	194.05791	0.663	6-Hydroxymellein	HMDB: HMDB0303675 KEGG: C02379 KNApSAcK: C00000554
C10H10O4	194.05791	0.663	Methyl caffeate	HMDB: HMDB0246032 KEGG: C10477 KNApSAcK: C00002759
C10H10O4	194.05791	0.663	3-(2-Hydroxy-3-methoxyphenyl)-2-propenoic acid	HMDB: HMDB0037644
C10H10O4	194.05791	0.663	Enalin A	KNApSAcK: C00034497
C10H10O4	194.05791	0.663	Repandiol	HMDB: HMDB0039606
C10H10O4	194.05791	0.663	5-Hydroxyconiferaldehyde	HMDB: HMDB0304215 KEGG: C12204 KNApSAcK: C00007611, C00052737
C10H10O4	194.05791	0.663	2E,4E,6Z,8Z-Decatetraenedioic acid	LipidMAPS: LMFA01170003, LMFA01170004, LMFA01170005
C10H10O4	194.05791	0.663	Bombardolide C	KNApSAcK: C00045692
C10H10O4	194.05791	0.663	Meconine	HMDB: HMDB0032652 KNApSAcK: C00051520
C10H10O4	194.05791	0.663	Scytalone	KEGG: C00779
C10H10O4	194.05791	0.663	Monoethyl phthalate	HMDB: HMDB0002120
C10H10O4	194.05791	0.663	4-Hydroxymellein	HMDB: HMDB0030765 KNApSAcK: C00000119, C00029969, C00032373

MSnスペクトル情報

Level: 2, プリカーサーm/z: 195.06525

Splash: splash10-002b-0900000000-d2d10ff8eb8c40e1aa55

m/z	Int.	NL	Rel.Int.
148.91	59593	46	1000
176.98	56474	18	947

Level: 3, プリカーサーm/z: 176.92690

Splash: splash10-0002-0900000000-6be3e62a17fcfe4a3178

m/z	Int.	NL	Rel.Int.
148.92	36850	28	1000

Level: 3, プリカーサーm/z: 148.91687

Splash: splash10-00di-0900000000-acfe148996884231b4a1

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MSnスペクトル情報

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