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4-ethyl-2-methyl-2-sulfanyl-octanoic acid

4-ethyl-2-methyl-2-sulfanyl-octanoic acid

Systemtic Name:4-ethyl-2-methyl-2-sulfanyl-octanoic acid
Openeye Name:4-ethyl-2-methyl-2-sulfanyl-octanoic acid
CAS Name:4-ethyl-2-mercapto-2-methyloctanoic acid
IUPAC Name:4-ethyl-2-methyl-2-sulfanyloctanoic acid
Traditional Name:4-ethyl-2-mercapto-2-methyl-caprylic acid
Formula: C11H22O2S
MolecularWeight: 218.35618
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(C)(C(=O)O)S


Isomeric SMILES

CCCCC(CC)CC(C)(C(=O)O)S


InChI

InChI=1S/C11H22O2S/c1-4-6-7-9(5-2)8-11(3,14)10(12)13/h9,14H,4-8H2,1-3H3,(H,12,13)


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