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Substance Name: 4-Hydoxy-1-(3-pyridyl)-1-butanone
RN: 59578-62-0
UNII: Z79CGY64XC
InChIKey: KTXUGZHJVRHQGP-UHFFFAOYSA-N

Note

  • May be metabolic product of tobacco-specific nitrosamines.

Molecular Formula

  • C9-H11-N-O2

Molecular Weight

  • 165.191
 
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Names and Synonyms

Name of Substance

  • 4-Hydoxy-1-(3-pyridyl)-1-butanone

Synonyms

  • 4-HPB
  • 4-Hydroxy-1-(3-pyridyl)-1-butanone
  • UNII-Z79CGY64XC

Systematic Name

  • 1-Butanone, 4-hydroxy-1-(3-pyridinyl)-

Registry Numbers

CAS Registry Number

  • 59578-62-0

FDA UNII

  • Z79CGY64XC

System Generated Number

  • 0059578620

Structure Descriptors

InChI

1S/C9H11NO2/c11-6-2-4-9(12)8-3-1-5-10-7-8/h1,3,5,7,11H,2,4,6H2

InChIKey

KTXUGZHJVRHQGP-UHFFFAOYSA-N

Smiles

c1ncc(C(CCCO)=O)cc1