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3-benzyl-4-oxo-2-thioxo-5-thiazolidineacetic acid, ethyl ester
SpectraBase Compound ID IYTkiqueaD3
InChI InChI=1S/C14H15NO3S2/c1-2-18-12(16)8-11-13(17)15(14(19)20-11)9-10-6-4-3-5-7-10/h3-7,11H,2,8-9H2,1H3
InChIKey CJSZRKWXHYLCGX-UHFFFAOYSA-N
Mol Weight 309.4 g/mol
Molecular Formula C14H15NO3S2
Exact Mass 309.049336 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ACz6yALfg0p
Name 3-BENZYL-4-OXO-2-THIOXO-5-THIAZOLIDINEACETIC ACID, ETHYL ESTER
Source of Sample W. Hanefeld, University of Hamburg, Hamburg, Germany
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15NO3S2
InChI InChI=1S/C14H15NO3S2/c1-2-18-12(16)8-11-13(17)15(14(19)20-11)9-10-6-4-3-5-7-10/h3-7,11H,2,8-9H2,1H3
InChIKey CJSZRKWXHYLCGX-UHFFFAOYSA-N
Melting Point 80-81C
Molecular Weight 309.41
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 5-THIAZOLIDINEACETIC ACID, 3-BENZYL- 4-OXO-2-THIOXO-, ETHYL ESTER