CHEBI:228691 - 4-(5-propyl-2-pyridyl)benzonitrile

ChEBI IDCHEBI:228691
ChEBI Name4-(5-propyl-2-pyridyl)benzonitrile
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H14N2
Net Charge0
Average Mass222.291
Monoisotopic Mass222.11570
SMILESCCCc1ccc(-c2ccc(C#N)cc2)nc1
InChIInChI=1S/C15H14N2/c1-2-3-13-6-9-15(17-11-13)14-7-4-12(10-16)5-8-14/h4-9,11H,2-3H2,1H3
InChIKeyHYBZAFSPFHNSAB-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
ChEBI Ontology
Outgoing Relation(s)
4-(5-propyl-2-pyridyl)benzonitrile (CHEBI:228691) is a phenylpyridine (CHEBI:38193)
IUPAC Name 
4-(5-propylpyridin-2-yl)benzonitrile
Manual XrefsDatabases
527144ChemSpider