Cotinine - The NIST WebBook

Cotinine
  • Formula: C10H12N2O
  • Molecular weight: 176.2151
  • IUPAC Standard InChI: InChI=1S/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3 Copy InChI version 1.06
  • IUPAC Standard InChIKey: UIKROCXWUNQSPJ-UHFFFAOYSA-N Copy
  • CAS Registry Number: 486-56-6
  • Chemical structure: C10H12N2O This structure is also available as a 2d Mol file or as a computed 3d SD file The 3d structure may be viewed using Java or Javascript.
  • Other names: 2-Pyrrolidinone, 1-methyl-5-(3-pyridinyl)-, (S)-; (-)-Cotinine; (S)-Cotinine; S-(-)-Cotinine; 1-Methyl-5-(3-pyridinyl)-2-pyrrolidinone
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  • Other data available:
    • Phase change data
    • Mass spectrum (electron ionization)
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  • Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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