cotinine N-oxide

cotinine N-oxide




Chemical Formula:
C10H12N2O2
Molecular Weight:
192.217 Daltons
Monoisotopic Mass:
192.0898776398 Daltons
SMILES:
C1(=O)(CC[CH](N(C)1)C2(C=N(=O)C=CC=2))
InChI:
1S/C10H12N2O2/c1-11-9(4-5-10(11)13)8-3-2-6-12(14)7-8/h2-3,6-7,9H,4-5H2,1H3/t9-/m0/s1
InChIKey:
CIPULDKLIIVIER-VIFPVBQESA-N

Synonyms
  • (5s)-1-methyl-5-(1-oxido-3-pyridinyl)-2-pyrrolidinone
  • 2-pyrrolidinone, 1-methyl-5-(1-oxido-3-pyridinyl)-, (5S)-
  • 2-pyrrolidinone, 1-methyl-5-(3-pyridinyl)-, N-oxide, (S)-

Databases
MetaCyc:  CPD-3185
ChEBI:  89087
PubChem (CID):  9815514
HMDB:  HMDB01411
RefMet:  Cotinine N-oxide
MetaNetX:  MNXM16855