7,9-dimethyldecane-2-thiol; 2,3,5,7-tetramethyloctane-1-thiol; 3,6,8-trimethylnonane-3-thiol

Systemtic Name: 7,9-dimethyldecane-2-thiol; 2,3,5,7-tetramethyloctane-1-thiol; 3,6,8-trimethylnonane-3-thiol Openeye Name: 7,9-dimethyldecane-2-thiol; 2,3,5,7-tetramethyloctane-1-thiol; 3,6,8-trimethylnonane-3-thiol CAS Name: 7,9-dimethyl-2-decanethiol; 2,3,5,7-tetramethyl-1-octanethiol; 3,6,8-trimethyl-3-nonanethiol IUPAC Name: 7,9-dimethyldecane-2-thiol; 2,3,5,7-tetramethyloctane-1-thiol; 3,6,8-trimethylnonane-3-thiol Traditional Name: 7,9-dimethyldecane-2-thiol; 2,3,5,7-tetramethyloctane-1-thiol; 3,6,8-trimethylnonane-3-thiol Formula: C36H78S3 MolecularWeight: 607.19952

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CCC(C)CC(C)C)S.CC(C)CC(C)CCCCC(C)S.CC(C)CC(C)CC(C)C(C)CS

Isomeric SMILES

CCC(C)(CCC(C)CC(C)C)S.CC(C)CC(C)CCCCC(C)S.CC(C)CC(C)CC(C)C(C)CS

InChI

InChI=1S/3C12H26S/c1-9(2)6-10(3)7-11(4)12(5)8-13;1-10(2)9-11(3)7-5-6-8-12(4)13;1-6-12(5,13)8-7-11(4)9-10(2)3/h9-13H,6-8H2,1-5H3;10-13H,5-9H2,1-4H3;10-11,13H,6-9H2,1-5H3