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2-[[C-[(2-keto-2-methoxy-ethyl)thio]-N-tosyl-carbonimidoyl]thio]acetic acid methyl ester
SpectraBase Compound ID KiM0XJen8gz
InChI InChI=1S/C14H17NO6S3/c1-10-4-6-11(7-5-10)24(18,19)15-14(22-8-12(16)20-2)23-9-13(17)21-3/h4-7H,8-9H2,1-3H3
InChIKey QVQBULRKZKANNV-UHFFFAOYSA-N
Mol Weight 391.47 g/mol
Molecular Formula C14H17NO6S3
Exact Mass 391.021801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D3TIN2lf6l6
Name 2-[[C-[(2-keto-2-methoxy-ethyl)thio]-N-tosyl-carbonimidoyl]thio]acetic acid methyl ester
Alternate Name(s) 2-[[[(2-methoxy-2-oxoethyl)thio]-(4-methylphenyl)sulfonyliminomethyl]thio]acetic acid methyl ester Methyl 2-[C-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-N-(4-methylphenyl)sulfonyl-carbonimidoyl]sulfanylethanoate Methyl 2-[C-(2-methoxy-2-oxo-ethyl)sulfanyl-N-(p-tolylsulfonyl)carbonimidoyl]sulfanylacetate Methyl 2-[C-(2-methoxy-2-oxoethyl)sulfanyl-N-(4-methylphenyl)sulfonylcarbonimidoyl]sulfanylacetate
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Formula C14H17NO6S3
InChI InChI=1S/C14H17NO6S3/c1-10-4-6-11(7-5-10)24(18,19)15-14(22-8-12(16)20-2)23-9-13(17)21-3/h4-7H,8-9H2,1-3H3
InChIKey QVQBULRKZKANNV-UHFFFAOYSA-N
Molecular Weight 391.471 g/mol
SMILES C(=NS(c1ccc(cc1)C)(=O)=O)(SCC(=O)OC)SCC(=O)OC
SPLASH splash10-0udl-8039000000-d11fda02d2a531b29cb1
Source of Spectrum Y-29-211-2
Wiley ID 1365249