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CHEBI:37829 - benzonitrile oxide

ChEBI IDCHEBI:37829
ChEBI Namebenzonitrile oxide
Stars
Last Modified22 May 2014
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC7H5NO
Net Charge0
Average Mass119.123
Monoisotopic Mass119.03711
SMILES[O-][N+]#Cc1ccccc1
InChIInChI=1S/C7H5NO/c9-8-6-7-4-2-1-3-5-7/h1-5H
InChIKeyQUNPTMGXSSDZHZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
benzonitrile oxide (CHEBI:37829) has functional parent benzonitrile (CHEBI:27991)
benzonitrile oxide (CHEBI:37829) is a nitrile oxide (CHEBI:47838)
IUPAC Name 
benzonitrile oxide
Synonyms  Source
benzonitrile, N-oxideChemIDplus
phenylnitrile oxideNIST Chemistry WebBook
benzylidyne(oxo)-λ5-azaneIUPAC
(benzylidyneammoniumyl)oxidanideIUPAC
Registry NumbersSources
Beilstein:109945Beilstein
CAS:873-67-6ChemIDplus
CAS:873-67-6NIST Chemistry WebBook