CHEBI:35709 - thujane

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ChEBI Name thujane
ChEBI ID CHEBI:35709
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C10H18
Net Charge 0
Average Mass 138.24992
Monoisotopic Mass 138.141
InChI InChI=1S/C10H18/c1-7(2)10-5-4-8(3)9(10)6-10/h7-9H,4-6H2,1-3H3
InChIKey GCTNBVHDRFKLLK-UHFFFAOYSA-N
SMILES CC(C)C12CCC(C)C1C2
ChEBI Ontology
Outgoing thujane (CHEBI:35709) is a monoterpene (CHEBI:35187)
thujane (CHEBI:35709) is a terpenoid fundamental parent (CHEBI:35662)
Incoming thujane monoterpenoid (CHEBI:50041) has parent hydride thujane (CHEBI:35709)
thujene (CHEBI:50030) has parent hydride thujane (CHEBI:35709)
IUPAC Names
4-methyl-1-(propan-2-yl)bicyclo[3.1.0]hexane
thujane
Synonyms Sources
1-isopropyl-4-methylbicyclo[3.1.0]hexane IUPAC
4-methyl-1-(1-methylethyl)bicyclo[3.1.0]hexane NIST Chemistry WebBook
dihydrosabinene NIST Chemistry WebBook
Database Link Database
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Registry Numbers Types Sources
2496757 Beilstein Registry Number Beilstein
471-12-5 CAS Registry Number NIST Chemistry WebBook
471-12-5 CAS Registry Number ChemIDplus
Last Modified
23 May 2008