2-methylnonan-2-yl 3-sulfanylpropanoate

Systemtic Name: 2-methylnonan-2-yl 3-sulfanylpropanoate Openeye Name: 1,1-dimethyloctyl 3-sulfanylpropanoate CAS Name: 3-mercaptopropanoic acid 2-methylnonan-2-yl ester IUPAC Name: 2-methylnonan-2-yl 3-sulfanylpropanoate Traditional Name: 3-mercaptopropionic acid 1,1-dimethyloctyl ester Formula: C13H26O2S MolecularWeight: 246.40934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C)(C)OC(=O)CCS

Isomeric SMILES

CCCCCCCC(C)(C)OC(=O)CCS

InChI

InChI=1S/C13H26O2S/c1-4-5-6-7-8-10-13(2,3)15-12(14)9-11-16/h16H,4-11H2,1-3H3