4-ethylhexan-3-ylsulfanium; propyl sulfate

Systemtic Name: 4-ethylhexan-3-ylsulfanium; propyl sulfate Openeye Name: 1,2-diethylbutylsulfonium; propyl sulfate CAS Name: 4-ethylhexan-3-ylsulfonium; propyl sulfate IUPAC Name: 4-ethylhexan-3-ylsulfanium; propyl sulfate Traditional Name: 1,2-diethylbutylsulfonium; propyl sulfate Formula: C11H26O4S2 MolecularWeight: 286.45174

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Descriptors Computed from Structure

Canonical SMILES:

CCCOS(=O)(=O)[O-].CCC(CC)C(CC)[SH2+]

Isomeric SMILES

CCCOS(=O)(=O)[O-].CCC(CC)C(CC)[SH2+]

InChI

InChI=1S/C8H18S.C3H8O4S/c1-4-7(5-2)8(9)6-3;1-2-3-7-8(4,5)6/h7-9H,4-6H2,1-3H3;2-3H2,1H3,(H,4,5,6)