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5-(o-anisidino)-1,2,3-thiadiazole-4-carboxylic acid, ethyl ester

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 UV-Vis

5-(o-anisidino)-1,2,3-thiadiazole-4-carboxylic acid, ethyl ester
SpectraBase Compound ID A4zbEE5cahd
InChI InChI=1S/C12H13N3O3S/c1-3-18-12(16)10-11(19-15-14-10)13-8-6-4-5-7-9(8)17-2/h4-7,13H,3H2,1-2H3
InChIKey CQAGKKLFLHOYLD-UHFFFAOYSA-N
Mol Weight 279.31 g/mol
Molecular Formula C12H13N3O3S
Exact Mass 279.067762 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KVYm0sB4Klw
Name 5-(o-anisidino)-1,2,3-thiadiazole-4-carboxylic acid, ethyl ester
Source of Sample M. Regitz, University of Saarlandes, Saarbruecken, Germany
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Formula C12H13N3O3S
InChI InChI=1S/C12H13N3O3S/c1-3-18-12(16)10-11(19-15-14-10)13-8-6-4-5-7-9(8)17-2/h4-7,13H,3H2,1-2H3
InChIKey CQAGKKLFLHOYLD-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 5878M
Solvent CDCl3
Synonyms THIADIAZOLE-4-CARBOXYLIC ACID, 1,- 2,3-, 5-/O-ANISIDINO/-, ETHYL ESTER