Chem
J-GLOBAL ID：200907057926643969   Nikkaji number：J1.123A

NNK

NNK
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C10H13N3O2
Molecular formula furigana： C10-H13-N3-O2
Molecular weight： 207.233
InChI： InChI=1S/C10H13N3O2/c1-13(12-15)7-3-5-10(14)9-4-2-6-11-8-9/h2,4,6,8H,3,5,7H2,1H3
InChI key： FLAQQSHRLBFIEZ-UHFFFAOYSA-N
SMILES： CN(CCCC(=O)c1cccnc1)N=O
Systematic name  (29)：
  • 4-[メチル(ニトロソ)アミノ]-1-(3-ピリジル)-1-ブタノン
  • 1-(3-ピリジニル)-4-[ニトロソ(メチル)アミノ]-1-ブタノン
  • 1-(3-ピリジニル)-4-(メチルニトロソアミノ)-1-ブタノン
  • 1-(3-ピリジニル)-4-(メチルニトロソアミノ)ブタン-1-オン
  • 1-(3-ピリジル)-4-[メチル(ニトロソ)アミノ]-1-ブタノン
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Other name (12)：
  • 4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanone
  • NNK
  • 3-Pyridyl 3-(N-methyl-N-nitrosoamino)propyl ketone
  • 4-(Methylnitrosoamino)-1-(3-pyridyl)-1-butanone
  • 1-(3-Pyridyl)-4-(methylnitrosoamino)-1-butanone
Show all
CAS registry number： 64091-91-4
Regulation number (1)：
  • OB6465000
KEGG COMPOUND： C16453
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