For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

4-(3-carboxy-2-thioureido)-1,5-dimethylpyrrole-2-carboxylic acid, diethyl ester

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

4-(3-carboxy-2-thioureido)-1,5-dimethylpyrrole-2-carboxylic acid, diethyl ester
SpectraBase Compound ID IrXF2SpAKUC
InChI InChI=1S/C13H19N3O4S/c1-5-19-11(17)10-7-9(8(3)16(10)4)14-12(21)15-13(18)20-6-2/h7H,5-6H2,1-4H3,(H2,14,15,18,21)
InChIKey HKZGQIQNLXMIMT-UHFFFAOYSA-N
Mol Weight 313.37 g/mol
Molecular Formula C13H19N3O4S
Exact Mass 313.109627 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID AGdXxlVBQPJ
Name ETHYL-1,5-DIMETHYL-4-(3-ETHOXYCARBONYLTHIOUREIDO)-PYRROL-2-CARBOXYLATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H19N3O4S
InChI InChI=1S/C13H19N3O4S/c1-5-19-11(17)10-7-9(8(3)16(10)4)14-12(21)15-13(18)20-6-2/h7H,5-6H2,1-4H3,(H2,14,15,18,21)
InChIKey HKZGQIQNLXMIMT-UHFFFAOYSA-N
Literature Reference Author L.GREHN
Literature Reference Citation CHEM.SCRIPTA,13,78(1978)
Molecular Weight 313.372 g/mol
Solvent DMSO-D6
Source File Reference UNIW20666