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4-methyl-2-[(5-nitro-2-pyridyl)thio]-5-thiazolecarboxylic acid, ethyl ester

View entire compound with spectra: 3 NMR, and 1 FTIR

4-methyl-2-[(5-nitro-2-pyridyl)thio]-5-thiazolecarboxylic acid, ethyl ester
SpectraBase Compound ID 9ye9IJ7U5fb
InChI InChI=1S/C12H11N3O4S2/c1-3-19-11(16)10-7(2)14-12(21-10)20-9-5-4-8(6-13-9)15(17)18/h4-6H,3H2,1-2H3
InChIKey HWBGVMZKFKBYAJ-UHFFFAOYSA-N
Mol Weight 325.36 g/mol
Molecular Formula C12H11N3O4S2
Exact Mass 325.019098 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8oTcrx4PNSS
Name 4-METHYL-2-[(5-NITRO-2-PYRIDYL)THIO]-5-THIAZOLECARBOXYLIC ACID,ETHYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11N3O4S2
InChI InChI=1S/C12H11N3O4S2/c1-3-19-11(16)10-7(2)14-12(21-10)20-9-5-4-8(6-13-9)15(17)18/h4-6H,3H2,1-2H3
InChIKey HWBGVMZKFKBYAJ-UHFFFAOYSA-N
Melting Point 113-115C
Molecular Weight 325.37
Solvent Polysol; Reference=TMS Spectrometer= Bruker AC-300
Synonyms 5-THIAZOLECARBOXYLIC ACID, 4-METHYL- 2-//5-NITRO-2-PYRIDYL/THIO/-, ETHYL ESTER