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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

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID dqpnNLYKLH
Name 4-(3-CARBOXY-2-THIOUREIDO)-1,5-DIMETHYLPYRROLE-2-CARBOXYLIC ACID, DIETHYL ESTER
Source of Sample L. Grehn, University of Uppsala, Uppsala, Sweden
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. 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
Molecular Weight 313.372009
Synonyms PYRROLE-2-CARBOXYLIC ACID, 4-/3-CARBOXY-2-THIOUREIDO/-1,5-D1- METHYL-, DIETHYL ESTER
Technique FILM (CAST FROM CHCl3)