2,6-dimethyl-3-prop-2-enylsulfanyl-heptan-4-one

Systemtic Name: 2,6-dimethyl-3-prop-2-enylsulfanyl-heptan-4-one Openeye Name: 3-allylsulfanyl-2,6-dimethyl-heptan-4-one CAS Name: 2,6-dimethyl-3-(prop-2-enylthio)-4-heptanone IUPAC Name: 2,6-dimethyl-3-prop-2-enylsulfanylheptan-4-one Traditional Name: 3-(allylthio)-2,6-dimethyl-heptan-4-one Formula: C12H22OS MolecularWeight: 214.36748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C(C(C)C)SCC=C

Isomeric SMILES

CC(C)CC(=O)C(C(C)C)SCC=C

InChI

InChI=1S/C12H22OS/c1-6-7-14-12(10(4)5)11(13)8-9(2)3/h6,9-10,12H,1,7-8H2,2-5H3