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2-{2-[(carboxymethyl)thio]acetamido}-4-methyl-3-thiophenecarboxylic acid, 3-ethyl 2-methyl ester

View entire compound with spectra: 2 NMR, and 1 FTIR

2-{2-[(carboxymethyl)thio]acetamido}-4-methyl-3-thiophenecarboxylic acid, 3-ethyl 2-methyl ester
SpectraBase Compound ID LlNfEvsHrb6
InChI InChI=1S/C13H17NO5S2/c1-4-19-13(17)11-8(2)5-21-12(11)14-9(15)6-20-7-10(16)18-3/h5H,4,6-7H2,1-3H3,(H,14,15)
InChIKey FRLYTEHEEMWTNG-UHFFFAOYSA-N
Mol Weight 331.4 g/mol
Molecular Formula C13H17NO5S2
Exact Mass 331.054815 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CAJIsiW6kwo
Name 2-{2-[(CARBOXYMETHYL)THIO]ACETAMIDO}-4-METHYL-3-THIOPHENECARBOXYLICACID, 3-ETHYL 2-METHYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO5S2
InChI InChI=1S/C13H17NO5S2/c1-4-19-13(17)11-8(2)5-21-12(11)14-9(15)6-20-7-10(16)18-3/h5H,4,6-7H2,1-3H3,(H,14,15)
InChIKey FRLYTEHEEMWTNG-UHFFFAOYSA-N
Melting Point 55-56C
Molecular Weight 331.41
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 3-THIOPHENECARBOXYLIC ACID, 2-/2-//CARBOXYMETHYL/THIO/ACETAMIDO/- 4-METHYL-, 3-ETHYL 2-METHYL ESTER