2,6-dimethyl-3-sulfanyl-heptan-4-one

Systemtic Name: 2,6-dimethyl-3-sulfanyl-heptan-4-one Openeye Name: 2,6-dimethyl-3-sulfanyl-heptan-4-one CAS Name: 3-mercapto-2,6-dimethyl-4-heptanone IUPAC Name: 2,6-dimethyl-3-sulfanylheptan-4-one Traditional Name: 3-mercapto-2,6-dimethyl-heptan-4-one Formula: C9H18OS MolecularWeight: 174.30362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C(C(C)C)S

Isomeric SMILES

CC(C)CC(=O)C(C(C)C)S

InChI

InChI=1S/C9H18OS/c1-6(2)5-8(10)9(11)7(3)4/h6-7,9,11H,5H2,1-4H3