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4-(2-thienyl)-3-thioallophanic acid, ethyl ester

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

4-(2-thienyl)-3-thioallophanic acid, ethyl ester
SpectraBase Compound ID LRg2nBsf4RB
InChI InChI=1S/C8H10N2O2S2/c1-2-12-8(11)10-7(13)9-6-4-3-5-14-6/h3-5H,2H2,1H3,(H2,9,10,11,13)
InChIKey PIHPCNNYUWMVOY-UHFFFAOYSA-N
Mol Weight 230.3 g/mol
Molecular Formula C8H10N2O2S2
Exact Mass 230.01837 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5OraN0Jbm26
Name 4-(2-THIENYL)-3-THIOALLOPHANIC ACID, ETHYL ESTER
Source of Sample L. Grehn, University of Uppsala, Uppsala, Sweden
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H10N2O2S2
InChI InChI=1S/C8H10N2O2S2/c1-2-12-8(11)10-7(13)9-6-4-3-5-14-6/h3-5H,2H2,1H3,(H2,9,10,11,13)
InChIKey PIHPCNNYUWMVOY-UHFFFAOYSA-N
Melting Point 151-152C
Molecular Weight 230.31
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms ALLOPHANIC ACID, 4-/2-THIENYL/- 3-THIO-, ETHYL ESTER