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2-hexylsulfanyl-2-phenyl-ethanoate

2-hexylsulfanyl-2-phenyl-ethanoate

Systemtic Name:2-hexylsulfanyl-2-phenyl-ethanoate
Openeye Name:2-hexylsulfanyl-2-phenyl-acetate
CAS Name:2-(hexylthio)-2-phenylacetate
IUPAC Name:2-hexylsulfanyl-2-phenylacetate
Traditional Name:2-(hexylthio)-2-phenyl-acetate
Formula: C14H19O2S-
MolecularWeight: 251.36446
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC(C1=CC=CC=C1)C(=O)[O-]


Isomeric SMILES

CCCCCCSC(C1=CC=CC=C1)C(=O)[O-]


InChI

InChI=1S/C14H20O2S/c1-2-3-4-8-11-17-13(14(15)16)12-9-6-5-7-10-12/h5-7,9-10,13H,2-4,8,11H2,1H3,(H,15,16)/p-1


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