1-[3-(2-methylpropyl)phenyl]ethanethiol

Systemtic Name: 1-[3-(2-methylpropyl)phenyl]ethanethiol Openeye Name: 1-(3-isobutylphenyl)ethanethiol CAS Name: 1-[3-(2-methylpropyl)phenyl]ethanethiol IUPAC Name: 1-[3-(2-methylpropyl)phenyl]ethanethiol Traditional Name: 1-(3-isobutylphenyl)ethanethiol Formula: C12H18S MolecularWeight: 194.33632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=CC=C1)C(C)S

Isomeric SMILES

CC(C)CC1=CC(=CC=C1)C(C)S

InChI

InChI=1S/C12H18S/c1-9(2)7-11-5-4-6-12(8-11)10(3)13/h4-6,8-10,13H,7H2,1-3H3