CHEBI:33084 - octalene

ChEBI IDCHEBI:33084
ChEBI Nameoctalene
Stars
Last Modified7 September 2008
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC14H12
Net Charge0
Average Mass180.250
Monoisotopic Mass180.09390
SMILESc1cccc2ccccccc=2cc1
InChIInChI=1S/C14H12/c1-2-6-10-14-12-8-4-3-7-11-13(14)9-5-1/h1-12H/b2-1-,4-3-,5-1-,6-2-,7-3-,8-4-,9-5-,10-6-,11-7-,12-8-,13-9-,13-11-,14-10-,14-12-,14-13-
InChIKeyOVPVGJFDFSJUIG-VFLSUHNHSA-N
ChEBI Ontology
Outgoing Relation(s)
octalene (CHEBI:33084) is a ortho-fused bicyclic hydrocarbon (CHEBI:35428)
octalene (CHEBI:33084) is a mancude carbobicyclic parent (CHEBI:50553)
IUPAC Name 
octalene
Registry NumbersSources
Beilstein:1904443Beilstein
Gmelin:1128059Gmelin
CAS:257-55-6NIST Chemistry WebBook