3,3,4-trimethyl-5-methylidene-octan-2-one

Systemtic Name: 3,3,4-trimethyl-5-methylidene-octan-2-one Openeye Name: 3,3,4-trimethyl-5-methylene-octan-2-one CAS Name: 3,3,4-trimethyl-5-methylene-2-octanone IUPAC Name: 3,3,4-trimethyl-5-methylideneoctan-2-one Traditional Name: 3,3,4-trimethyl-5-propyl-hex-5-en-2-one Formula: C12H22O MolecularWeight: 182.30248

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C)C(C)C(C)(C)C(=O)C

Isomeric SMILES

CCCC(=C)C(C)C(C)(C)C(=O)C

InChI

InChI=1S/C12H22O/c1-7-8-9(2)10(3)12(5,6)11(4)13/h10H,2,7-8H2,1,3-6H3