4,4,6-trimethyloxepan-2-one

Systemtic Name: 4,4,6-trimethyloxepan-2-one Openeye Name: 4,4,6-trimethyloxepan-2-one CAS Name: 4,4,6-trimethyl-2-oxepanone IUPAC Name: 4,4,6-trimethyloxepan-2-one Traditional Name: 4,4,6-trimethyloxepan-2-one Formula: C9H16O2 MolecularWeight: 156.22214

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(=O)OC1)(C)C

Isomeric SMILES

CC1CC(CC(=O)OC1)(C)C

InChI

InChI=1S/C9H16O2/c1-7-4-9(2,3)5-8(10)11-6-7/h7H,4-6H2,1-3H3