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1-propoxyhexyl 2-sulfanylbutanoate

1-propoxyhexyl 2-sulfanylbutanoate

Systemtic Name:1-propoxyhexyl 2-sulfanylbutanoate
Openeye Name:1-propoxyhexyl 2-sulfanylbutanoate
CAS Name:2-mercaptobutanoic acid 1-propoxyhexyl ester
IUPAC Name:1-propoxyhexyl 2-sulfanylbutanoate
Traditional Name:2-mercaptobutyric acid 1-propoxyhexyl ester
Formula: C13H26O3S
MolecularWeight: 262.40874
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(OCCC)OC(=O)C(CC)S


Isomeric SMILES

CCCCCC(OCCC)OC(=O)C(CC)S


InChI

InChI=1S/C13H26O3S/c1-4-7-8-9-12(15-10-5-2)16-13(14)11(17)6-3/h11-12,17H,4-10H2,1-3H3


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