4,5,5-trimethylbicyclo[2.1.1]hex-1-en-3-one

Systemtic Name: 4,5,5-trimethylbicyclo[2.1.1]hex-1-en-3-one Openeye Name: 4,5,5-trimethylbicyclo[2.1.1]hex-1-en-3-one CAS Name: 4,5,5-trimethyl-3-bicyclo[2.1.1]hex-1-enone IUPAC Name: 4,5,5-trimethylbicyclo[2.1.1]hex-1-en-3-one Traditional Name: 4,5,5-trimethylbicyclo[2.1.1]hex-1-en-3-one Formula: C9H12O MolecularWeight: 136.19098

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC(=O)C1(C2)C)C

Isomeric SMILES

CC1(C2=CC(=O)C1(C2)C)C

InChI

InChI=1S/C9H12O/c1-8(2)6-4-7(10)9(8,3)5-6/h4H,5H2,1-3H3