3,3-dimethylbutan-2-one; 2,6-dimethylheptan-4-one

Systemtic Name: 3,3-dimethylbutan-2-one; 2,6-dimethylheptan-4-one Openeye Name: 3,3-dimethylbutan-2-one; 2,6-dimethylheptan-4-one CAS Name: 3,3-dimethyl-2-butanone; 2,6-dimethyl-4-heptanone IUPAC Name: 3,3-dimethylbutan-2-one; 2,6-dimethylheptan-4-one Traditional Name: 2,6-dimethylheptan-4-one; pinacolone Formula: C15H30O2 MolecularWeight: 242.3975

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)CC(C)C.CC(=O)C(C)(C)C

Isomeric SMILES

CC(C)CC(=O)CC(C)C.CC(=O)C(C)(C)C

InChI

InChI=1S/C9H18O.C6H12O/c1-7(2)5-9(10)6-8(3)4;1-5(7)6(2,3)4/h7-8H,5-6H2,1-4H3;1-4H3