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3-hexylsulfanylhexyl hexanoate

3-hexylsulfanylhexyl hexanoate

Systemtic Name:3-hexylsulfanylhexyl hexanoate
Openeye Name:3-hexylsulfanylhexyl hexanoate
CAS Name:hexanoic acid 3-(hexylthio)hexyl ester
IUPAC Name:3-hexylsulfanylhexyl hexanoate
Traditional Name:hexanoic acid 3-(hexylthio)hexyl ester
Formula: C18H36O2S
MolecularWeight: 316.54224
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC(CCC)CCOC(=O)CCCCC


Isomeric SMILES

CCCCCCSC(CCC)CCOC(=O)CCCCC


InChI

InChI=1S/C18H36O2S/c1-4-7-9-11-16-21-17(12-6-3)14-15-20-18(19)13-10-8-5-2/h17H,4-16H2,1-3H3


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