CHEBI:50033 - (−)-α-thujene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (−)-α-thujene
ChEBI ID CHEBI:50033
ChEBI ASCII Name (-)-alpha-thujene
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C10H16
Net Charge 0
Average Mass 136.23404
Monoisotopic Mass 136.12520
InChI InChI=1S/C10H16/c1-7(2)10-5-4-8(3)9(10)6-10/h4,7,9H,5-6H2,1-3H3/t9-,10-/m1/s1
InChIKey KQAZVFVOEIRWHN-NXEZZACHSA-N
SMILES [H][C@]12C[C@]1(CC=C2C)C(C)C
ChEBI Ontology
Outgoing (−)-α-thujene (CHEBI:50033) is a α-thujene (CHEBI:50031)
(−)-α-thujene (CHEBI:50033) is enantiomer of (+)-α-thujene (CHEBI:50032)
Incoming (+)-α-thujene (CHEBI:50032) is enantiomer of (−)-α-thujene (CHEBI:50033)
IUPAC Name
(1R,5S)-2-methyl-5-(propan-2-yl)bicyclo[3.1.0]hex-2-ene
Synonym Source
(1R,5S)-5-isopropyl-2-methylbicyclo[3.1.0]hex-2-ene IUPAC
Registry Number Type Source
3917-48-4 CAS Registry Number ChemIDplus
Last Modified
18 September 2009