(3R,4S)-2,2,4-trimethyl-3-phenylsulfanyl-oxolane

Systemtic Name: (3R,4S)-2,2,4-trimethyl-3-phenylsulfanyl-oxolane Openeye Name: (3R,4S)-2,2,4-trimethyl-3-phenylsulfanyl-tetrahydrofuran CAS Name: (3R,4S)-2,2,4-trimethyl-3-(phenylthio)oxolane IUPAC Name: (3R,4S)-2,2,4-trimethyl-3-phenylsulfanyloxolane Traditional Name: (3R,4S)-2,2,4-trimethyl-3-(phenylthio)tetrahydrofuran Formula: C13H18OS MolecularWeight: 222.34642

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Descriptors Computed from Structure

Canonical SMILES:

CC1COC(C1SC2=CC=CC=C2)(C)C

Isomeric SMILES

C[C@H]1COC([C@@H]1SC2=CC=CC=C2)(C)C

InChI

InChI=1S/C13H18OS/c1-10-9-14-13(2,3)12(10)15-11-7-5-4-6-8-11/h4-8,10,12H,9H2,1-3H3/t10-,12+/m0/s1