(5S,6R)-5-methoxy-2,2-dimethyl-6-methylsulfanyl-octan-3-one

Systemtic Name: (5S,6R)-5-methoxy-2,2-dimethyl-6-methylsulfanyl-octan-3-one Openeye Name: (5S,6R)-5-methoxy-2,2-dimethyl-6-methylsulfanyl-octan-3-one CAS Name: (5S,6R)-5-methoxy-2,2-dimethyl-6-(methylthio)-3-octanone IUPAC Name: (5S,6R)-5-methoxy-2,2-dimethyl-6-methylsulfanyloctan-3-one Traditional Name: (5S,6R)-5-methoxy-2,2-dimethyl-6-(methylthio)octan-3-one Formula: C12H24O2S MolecularWeight: 232.38276

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CC(=O)C(C)(C)C)OC)SC

Isomeric SMILES

CC[C@H]([C@H](CC(=O)C(C)(C)C)OC)SC

InChI

InChI=1S/C12H24O2S/c1-7-10(15-6)9(14-5)8-11(13)12(2,3)4/h9-10H,7-8H2,1-6H3/t9-,10+/m0/s1