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2-(tosylthio)acetic acid methyl ester
SpectraBase Compound ID BxLCYdGxDV1
InChI InChI=1S/C10H12O4S2/c1-8-3-5-9(6-4-8)16(12,13)15-7-10(11)14-2/h3-6H,7H2,1-2H3
InChIKey WIDXRFFEKXIVDG-UHFFFAOYSA-N
Mol Weight 260.32 g/mol
Molecular Formula C10H12O4S2
Exact Mass 260.017701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4nLsdH1KpjZ
Name 2-(tosylthio)acetic acid methyl ester
Alternate Name(s) 2-[(4-methylphenyl)sulfonylthio]acetic acid methyl ester Methyl 2-(4-methylphenyl)sulfonylsulfanylacetate Methyl 2-(4-methylphenyl)sulfonylsulfanylethanoate Methyl 2-(p-tolylsulfonylsulfanyl)acetate
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Formula C10H12O4S2
InChI InChI=1S/C10H12O4S2/c1-8-3-5-9(6-4-8)16(12,13)15-7-10(11)14-2/h3-6H,7H2,1-2H3
InChIKey WIDXRFFEKXIVDG-UHFFFAOYSA-N
Molecular Weight 260.322 g/mol
SMILES C(SS(c1ccc(cc1)C)(=O)=O)C(=O)OC
SPLASH splash10-052f-9520000000-eb5b8b5230946340f6d3
Source of Spectrum B-53-402-9
Wiley ID 747026