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dodecan-3-ylsulfanium ethanoate

dodecan-3-ylsulfanium ethanoate

Systemtic Name:dodecan-3-ylsulfanium ethanoate
Openeye Name:1-ethyldecylsulfonium acetate
CAS Name:dodecan-3-ylsulfonium acetate
IUPAC Name:dodecan-3-ylsulfanium acetate
Traditional Name:1-ethyldecylsulfonium acetate
Formula: C14H30O2S
MolecularWeight: 262.4518
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CC)[SH2+].CC(=O)[O-]


Isomeric SMILES

CCCCCCCCCC(CC)[SH2+].CC(=O)[O-]


InChI

InChI=1S/C12H26S.C2H4O2/c1-3-5-6-7-8-9-10-11-12(13)4-2;1-2(3)4/h12-13H,3-11H2,1-2H3;1H3,(H,3,4)


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