hexane-1,6-diol; 3,5,5-trimethylcyclohex-2-en-1-one

Systemtic Name: hexane-1,6-diol; 3,5,5-trimethylcyclohex-2-en-1-one Openeye Name: hexane-1,6-diol; 3,5,5-trimethylcyclohex-2-en-1-one CAS Name: hexane-1,6-diol; 3,5,5-trimethyl-1-cyclohex-2-enone IUPAC Name: hexane-1,6-diol; 3,5,5-trimethylcyclohex-2-en-1-one Traditional Name: hexane-1,6-diol; 3,5,5-trimethylcyclohex-2-en-1-one Formula: C15H28O3 MolecularWeight: 256.38102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)CC(C1)(C)C.C(CCCO)CCO

Isomeric SMILES

CC1=CC(=O)CC(C1)(C)C.C(CCCO)CCO

InChI

InChI=1S/C9H14O.C6H14O2/c1-7-4-8(10)6-9(2,3)5-7;7-5-3-1-2-4-6-8/h4H,5-6H2,1-3H3;7-8H,1-6H2