hexylsulfanyl hydrogen sulfate

Systemtic Name: hexylsulfanyl hydrogen sulfate Openeye Name: hexylsulfanyl hydrogen sulfate CAS Name: 1-hexanesulfenic acid IUPAC Name: hexylsulfanyl hydrogen sulfate Traditional Name: sulfuric acid (hexylthio) ester Formula: C6H14O4S2 MolecularWeight: 214.30296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSOS(=O)(=O)O

Isomeric SMILES

CCCCCCSOS(=O)(=O)O

InChI

InChI=1S/C6H14O4S2/c1-2-3-4-5-6-11-10-12(7,8)9/h2-6H2,1H3,(H,7,8,9)