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3-(phenylsulfanylmethyl)cyclohexan-1-one

3-(phenylsulfanylmethyl)cyclohexan-1-one

Systemtic Name:3-(phenylsulfanylmethyl)cyclohexan-1-one
Openeye Name:3-(phenylsulfanylmethyl)cyclohexanone
CAS Name:3-[(phenylthio)methyl]-1-cyclohexanone
IUPAC Name:3-(phenylsulfanylmethyl)cyclohexan-1-one
Traditional Name:3-[(phenylthio)methyl]cyclohexanone
Formula: C13H16OS
MolecularWeight: 220.33054
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(=O)C1)CSC2=CC=CC=C2


Isomeric SMILES

C1CC(CC(=O)C1)CSC2=CC=CC=C2


InChI

InChI=1S/C13H16OS/c14-12-6-4-5-11(9-12)10-15-13-7-2-1-3-8-13/h1-3,7-8,11H,4-6,9-10H2


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