3,3-dimethyl-2-methylidene-1-phenyl-butan-1-one

Systemtic Name: 3,3-dimethyl-2-methylidene-1-phenyl-butan-1-one Openeye Name: 3,3-dimethyl-2-methylene-1-phenyl-butan-1-one CAS Name: 3,3-dimethyl-2-methylene-1-phenyl-1-butanone IUPAC Name: 3,3-dimethyl-2-methylidene-1-phenylbutan-1-one Traditional Name: 2-tert-butyl-1-phenyl-prop-2-en-1-one Formula: C13H16O MolecularWeight: 188.26554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=C)C(=O)C1=CC=CC=C1

Isomeric SMILES

CC(C)(C)C(=C)C(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H16O/c1-10(13(2,3)4)12(14)11-8-6-5-7-9-11/h5-9H,1H2,2-4H3