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Substance Name: 3-Butanone, 4-(butylnitrosamino)-
RN: 61734-90-5
InChIKey: PSHQOARTDNZNHE-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • Tumor Data

Molecular Formula

  • C8-H16-N2-O2

Molecular Weight

  • 172.226
 
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Names and Synonyms

Synonyms

  • BRN 2246430
  • N-Butyl-N-(2-oxobutyl)nitrosamine
  • N-Butyl-N-(3-oxobutyl)nitrosamine
  • N-Nitroso-N-(3-oxobutyl)butylamine

Systematic Name

  • 3-Butanone, 4-(butylnitrosamino)-

Registry Numbers

CAS Registry Number

  • 61734-90-5

System Generated Number

  • 0061734905

Structure Descriptors

InChI

1S/C8H16N2O2/c1-3-5-6-10(9-12)7-8(11)4-2/h3-7H2,1-2H3

InChIKey

PSHQOARTDNZNHE-UHFFFAOYSA-N

Smiles

N(CC(CC)=O)(CCCC)N=O