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5-(3-carboxy-2-thioureido)-2-furoic acid, diethyl ester
SpectraBase Compound ID G6ijl9WgVpH
InChI InChI=1S/C11H14N2O5S/c1-3-16-9(14)7-5-6-8(18-7)12-10(19)13-11(15)17-4-2/h5-6H,3-4H2,1-2H3,(H2,12,13,15,19)
InChIKey HHXIMMXNNCTAJD-UHFFFAOYSA-N
Mol Weight 286.3 g/mol
Molecular Formula C11H14N2O5S
Exact Mass 286.062343 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H7MJWC09Tk8
Name 5-(3-CARBOXY-2-THIOUREIDO)-2-FUROIC 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 C11H14N2O5S
InChI InChI=1S/C11H14N2O5S/c1-3-16-9(14)7-5-6-8(18-7)12-10(19)13-11(15)17-4-2/h5-6H,3-4H2,1-2H3,(H2,12,13,15,19)
InChIKey HHXIMMXNNCTAJD-UHFFFAOYSA-N
Molecular Weight 286.31
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms ALLOPHANIC ACID, 4-/5-CARBOXY- 2-FURYL/-3-THIO-, DIETHYL ESTER 2-FUROIC ACID, 5-/3-CARBOXY-2-THIOUREIDO/-, DIETHYL ESTER