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3-(2-Acetoxy-phenyl)-1,2,4-thiadiazole-5-carboxylic acid, ethyl ester
SpectraBase Compound ID 8PTtYim6bSw
InChI InChI=1S/C13H12N2O4S/c1-3-18-13(17)12-14-11(15-20-12)9-6-4-5-7-10(9)19-8(2)16/h4-7H,3H2,1-2H3
InChIKey NULKRXKNTRILGB-UHFFFAOYSA-N
Mol Weight 292.31 g/mol
Molecular Formula C13H12N2O4S
Exact Mass 292.051778 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 25wIqp7FjWe
Name 3-(2-Acetoxy-phenyl)-1,2,4-thiadiazole-5-carboxylic acid, ethyl ester
CAS Registry Number 118134-12-6
Comments reassigned
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Formula C13H12N2O4S
InChI InChI=1S/C13H12N2O4S/c1-3-18-13(17)12-14-11(15-20-12)9-6-4-5-7-10(9)19-8(2)16/h4-7H,3H2,1-2H3
InChIKey NULKRXKNTRILGB-UHFFFAOYSA-N
Literature Reference P.A. Brownsort, R.M. Paton, J. Chem. Soc. Perkin I 2339 (1987).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3