ピーク情報

＜香辛料類＞にんにくおろし

pos

Peak #4392 MN MID: SE122_S170761_M90

m/z: 434.14132, RT: 42.33, 強度: 21250, ログ強度: 0.57, 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: (9 names) N-Acetylaspartylglutamylglutamate;N-Acetyl-L-aspartyl-L-glutamyl-L-glutamate;NAAG2;Amustaline;2-[(Acridin-9-ylamino)methyl]-4-[bis(2-chloroethyl)amino]butanoic acid;Dysideaproline D;(+)-Dysideaproline...

DBごとのヒット数: ALL 5 KG 1 KN 2 HM 2

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
C16H23O11N3	433.13326	1.814	N-Acetylaspartylglutamylglutamate	KEGG: C20776
C22H25O2N3Cl2	433.13238	3.835	Amustaline	HMDB: HMDB0248368
C22H25O2N3Cl2	433.13238	3.835	2-[(Acridin-9-ylamino)methyl]-4-[bis(2-chloroethyl)amino]butanoic acid	HMDB: HMDB0255367
C19H29O2N3SCl2	433.13575	-3.948	Dysideaproline D	KNApSAcK: C00034491
C19H29O2N3SCl2	433.13575	-3.948	Dysideaproline E	KNApSAcK: C00034492

MSnスペクトル情報

Level: 2, プリカーサーm/z: 434.14124

Splash: splash10-0a4i-0149000000-57096a21500bb270dca7

m/z	Int.	NL	Rel.Int.
305.03	42111	129	1000
288.03	15699	146	372
273.06	6914	161	164
174.03	5990	260	142
416.11	2158	18	51

Level: 3, プリカーサーm/z: 305.02664

Splash: splash10-000i-0090000000-d9e071b970cb47de6d2b

m/z	Int.	NL	Rel.Int.
288.06	21492	17	1000
174.00	1799	131	83

FlavonoidSearch結果

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	Flavone	6'',6''-Dimethylpyrano[2'',3'':7,8]flavone
[Isoflavan]-A(2OH)-B(2OH, 1OMe)	Isoflavan	3',8-Dihydroxyvestitol
[Dihydroflavonol]-A(2OH)-B(2OH)	Dihydroflavonol	3,5,7,3',5'-Pentahydroxyflavanone
[Dihydroflavonol]-A(2OH)-B(2OH)	Dihydroflavonol	Taxifolin
[Dihydroflavonol]-A(2OH)-B(2OH)	Dihydroflavonol	Dihydromorin
[Dihydroflavonol]-A(3OH)-B(1OH)	Dihydroflavonol	3,5,7,8,4'-Pentahydroxyflavanone
[Dihydroflavonol]-A(2OH)-B(2OH)	Dihydroflavonol	8-Hydroxyfustin
[Dihydroflavonol]-A(2OH)-B(2OH)	Dihydroflavonol	3,5,7,2',5'-Pentahydroxyflavanone
[Dihydroflavonol]-A(2OH)-B(2OH)	Dihydroflavonol	3,5,7,2',6'-Pentahydroxyflavanone
[Dihydroflavonol]-A(1OH)-B(3OH)	Dihydroflavonol	Dihydrorobinetin
[Flavanone]-A(2OH)-B(3OH)	Flavanone	5,7,3',4',5'-Pentahydroxyflavanone
[2'-Hydroxychalcone]-A(3OH)-B(3OH)	2'-Hydroxychalcone	3,4,5,2',4',6'-Hexahydroxychalcone
[Flavan 3-ol]-A(1OH, 1OMe)-B(2OH)	Flavan 3-ol	Catechin-7-methyl ether
[Flavan 3-ol]-A(2OH)-B(1OH, 1OMe)	Flavan 3-ol	Symplocosidin
[Flavan 3-ol]-A(2OH)-B(1OH, 1OMe)	Flavan 3-ol	Catechin 4'-methyl ether
[Flavan 3-ol]-A(2OH)-B(1OH, 1OMe)	Flavan 3-ol	Catechin-3'-methyl ether
[Auronol]-A(2OH)-B(2OH)	Auronol	Nigrescin
[Auronol]-A(2OH)-B(2OH)	Auronol	Alphitonin
[beta-Hydroxy(or Oxodihydro)chalcone]-A(3OH)-B(2OH)	beta-Hydroxy(or Oxodihydro)chalcone	3,4,2',4',6',beta-Hexahydroxychalcone
[Dihydrochalcone alpha-ol]-A(1OH, 1OMe)-B(2OH)	Dihydrochalcone alpha-ol	3,4,4',alpha-Tetrahydroxy-2'-methoxydihydrochalcone
[Dihydrochalcone beta-ol]-A(2OH, 1OMe)-B(1OH)	Dihydrochalcone beta-ol	4,2',4',beta-Tetrahydroxy-6'-methoxydihydrochalcone
[2-Hydroxyflavanone]-A(2OH)-B(2OH)	2-Hydroxyflavanone	2,5,7,3',4'-Pentahydroxyflavanone
[Flavone]-A(2OH, 1Cl)-B(1OH)	Flavone	6-Chloroapigenin
[Flavan 3,4-diol]-A(1OH, 1OMe)-B(1OH)	Flavan 3,4-diol	Ortin-4alpha-ol 8-methyl ether

Level: 3, プリカーサーm/z: 288.02948

Splash: splash10-00di-0900000000-0887d5b27888509b0577