ピーク情報

＜貝類＞かき養殖生

pos

Peak #790 MN MID: SE117_S102921_M90

m/z: 166.08618, RT: 26.54, 強度: 20013, ログ強度: 0.97, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 198

DB検索結果: (29 names) Gentiatibetine;4-Ethoxybenzamide;2-Acetyl-3-hydroxy-5,6-dimethylpyridine;L-Phenylalanine;L-beta-Phenylalanine;(R)-3-Amino-3-phenylpropanoate;2-Amino-3-(4-hydroxyphenyl)propanal;Benzyl glycinate;Metolc...

DBごとのヒット数: ALL 26 KG 8 KN 3 HM 15

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
C9H11O2N	165.07898	-0.483	Gentiatibetine	HMDB: HMDB0033485
C9H11O2N	165.07898	-0.483	4-Ethoxybenzamide	HMDB: HMDB0246418
C9H11O2N	165.07898	-0.483	2-Acetyl-3-hydroxy-5,6-dimethylpyridine	KNApSAcK: C00054399
C9H11O2N	165.07898	-0.483	L-Phenylalanine	HMDB: HMDB0000159, HMDB0250791 KEGG: C02057, C00079, C02265 KNApSAcK: C00001386
C9H11O2N	165.07898	-0.483	L-beta-Phenylalanine	KEGG: C20487, C20488
C9H11O2N	165.07898	-0.483	L-Tyrosinal	HMDB: HMDB0244978 KEGG: C22021
C9H11O2N	165.07898	-0.483	Benzyl glycinate	HMDB: HMDB0059934
C9H11O2N	165.07898	-0.483	Metolcarb	KEGG: C18747
C9H11O2N	165.07898	-0.483	D-Phenyl alanine	HMDB: HMDB0250790
C9H11O2N	165.07898	-0.483	4-Hydroxy-1-(3-pyridinyl)-1-butanone	HMDB: HMDB0062402 KEGG: C19565
C9H11O2N	165.07898	-0.483	2-Acetyl-6-ethyl-3-hydroxypyridine	KNApSAcK: C00054401
C9H11O2N	165.07898	-0.483	p-(Acetylamino)benzyl alcohol	KNApSAcK: C00044988
C9H11O2N	165.07898	-0.483	1-Isopropyl-4-nitrobenzene	HMDB: HMDB0243912
C9H11O2N	165.07898	-0.483	N-(4-Methoxyphenyl)acetamide	HMDB: HMDB0255013
C9H11O2N	165.07898	-0.483	Ethenzamide	HMDB: HMDB0245110
C9H11O2N	165.07898	-0.483	Tricaine	HMDB: HMDB0252029 KEGG: C18090
C9H11O2N	165.07898	-0.483	Methyl N-methylanthranilate	HMDB: HMDB0034169
C9H11O2N	165.07898	-0.483	Phenyl-Alanine	HMDB: HMDB0256428
C9H11O2N	165.07898	-0.483	3-Pyridinebutanoic acid	HMDB: HMDB0001007
C9H11O2N	165.07898	-0.483	Benzocaine	HMDB: HMDB0004992 KEGG: C07527
C9H11O2N	165.07898	-0.483	4-(Dimethylamino)benzoic acid	HMDB: HMDB0246304
C9H11O2N	165.07898	-0.483	(3,5-Dimethylphenyl)carbamic acid	HMDB: HMDB0244732
C9H11O2N	165.07898	-0.483	5-(3-Pyridyl)-2-hydroxytetrahydrofuran	HMDB: HMDB0062407 KEGG: C19578
C9H11O2N	165.07898	-0.483	Ethyl 2-aminobenzoate	HMDB: HMDB0033589
C9H11O2N	165.07898	-0.483	N,N-Dimethylanthranilic acid	HMDB: HMDB0302634
C9H11O2N	165.07898	-0.483	Norsalsolinol	HMDB: HMDB0006044

MSnスペクトル情報

Level: 2, プリカーサーm/z: 166.08586

Splash: splash10-014i-0900000000-347d2f00661b052a3999

m/z	Int.	NL	Rel.Int.
119.94	1600347	46	1000

Level: 3, プリカーサーm/z: 119.94168

Splash: splash10-0006-9300000000-0984ee76b2ddf79dddbc

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

関連ピーク情報

m/z	Int.	NL	Rel.Int.
92.97	8106	27	1000
102.95	3014	17	371
79.92	567	40	69
119.91	466	0	57

ピーク番号	保持時間 (min)	m/z	m/z差分	ログ強度	アダクト	DB検索結果	ヒット数	MSn	FS2	FS3	共有数
	26.51	207.11266	41.0265	0.52	[M+ACN+H]+	(29 names) Gentiatibetine; 4-Ethoxybenzamide; 2-Acetyl-3-hydroxy-5,6-dimethylpyridine; L-Phenylalanine; L-beta-Phenylalanine; (R)-3-Amino-3-phenylpropanoate; 2-Amino-3-(4-hydroxyphenyl)propanal; Benzyl glycinate; Metolc...	ALL 26 KG 8 KN 3 HM 15	MS2			166
790	26.54	166.08618	0.0000	0.97	[M+H]+	(29 names) Gentiatibetine; 4-Ethoxybenzamide; 2-Acetyl-3-hydroxy-5,6-dimethylpyridine; L-Phenylalanine; L-beta-Phenylalanine; (R)-3-Amino-3-phenylpropanoate; 2-Amino-3-(4-hydroxyphenyl)propanal; Benzyl glycinate; Metolc...	ALL 26 KG 8 KN 3 HM 15	MS2 MS3			198