John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=Bjsea2ZCFOi SpectraBase Spectrum ID=1j0mnf6zjB3

(accessed ).
{[(2-carbamoyl-3-thienyl)amino]methylene}malonic acid, diethyl ester
SpectraBase Compound ID Bjsea2ZCFOi
InChI InChI=1S/C13H16N2O5S/c1-3-19-12(17)8(13(18)20-4-2)7-15-9-5-6-21-10(9)11(14)16/h5-7,15H,3-4H2,1-2H3,(H2,14,16)
InChIKey SLGPAYUGWSQPGJ-UHFFFAOYSA-N
Mol Weight 312.34 g/mol
Molecular Formula C13H16N2O5S
Exact Mass 312.077994 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 1j0mnf6zjB3
Name {[(2-CARBAMOYL-3-THIENYL)AMINO]METHYLENE}MALONIC ACID, DIETHYL ESTER
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
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Formula C13H16N2O5S
InChI InChI=1S/C13H16N2O5S/c1-3-19-12(17)8(13(18)20-4-2)7-15-9-5-6-21-10(9)11(14)16/h5-7,15H,3-4H2,1-2H3,(H2,14,16)
InChIKey SLGPAYUGWSQPGJ-UHFFFAOYSA-N
Melting Point 145-148C
Molecular Weight 312.35
SpectraBase Batch ID 4kzeoBMa7T8
Technique KBr WAFER