(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-ene-2-thiol

Systemtic Name: (E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-ene-2-thiol Openeye Name: (E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-ene-2-thiol CAS Name: (E)-4-(2,6,6-trimethyl-1-cyclohex-2-enyl)-3-butene-2-thiol IUPAC Name: (E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-ene-2-thiol Traditional Name: (E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-ene-2-thiol Formula: C13H22S MolecularWeight: 210.37878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCCC(C1C=CC(C)S)(C)C

Isomeric SMILES

CC1=CCCC(C1/C=C/C(C)S)(C)C

InChI

InChI=1S/C13H22S/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h6-8,11-12,14H,5,9H2,1-4H3/b8-7+