3-ethynyl-5,5-dimethyl-cyclohex-2-en-1-one

Systemtic Name: 3-ethynyl-5,5-dimethyl-cyclohex-2-en-1-one Openeye Name: 3-ethynyl-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 3-ethynyl-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 3-ethynyl-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 3-ethynyl-5,5-dimethyl-cyclohex-2-en-1-one Formula: C10H12O MolecularWeight: 148.20168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12O/c1-4-8-5-9(11)7-10(2,3)6-8/h1,5H,6-7H2,2-3H3