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4,4-diphenyl-1-isopropyl-5-thioxo-3-pyrrolidinepropionic acid, ethyl ester
SpectraBase Compound ID IrygKlUydeg
InChI InChI=1S/C24H29NO2S/c1-4-27-22(26)16-15-21-17-25(18(2)3)23(28)24(21,19-11-7-5-8-12-19)20-13-9-6-10-14-20/h5-14,18,21H,4,15-17H2,1-3H3
InChIKey MLJRLOMLWSOTKR-UHFFFAOYSA-N
Mol Weight 395.56 g/mol
Molecular Formula C24H29NO2S
Exact Mass 395.1919 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CxTDNXiVn2b
Name 4,4-diphenyl-1-isopropyl-5-thioxo-3-pyrrolidinepropionic acid, ethyl ester
Source of Sample C. D. Lunsford, A. H. Robins Company, Inc., Richmond, Virginia
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Formula C24H29NO2S
InChI InChI=1S/C24H29NO2S/c1-4-27-22(26)16-15-21-17-25(18(2)3)23(28)24(21,19-11-7-5-8-12-19)20-13-9-6-10-14-20/h5-14,18,21H,4,15-17H2,1-3H3
InChIKey MLJRLOMLWSOTKR-UHFFFAOYSA-N
Instrument Name Varian A-60
Literature Reference JMCH 10, 214(1967)
Sadtler NMR Number 5455M
Solvent CDCl3
Synonyms 3-PYRROLIDINEPROPIONIC ACID, 4,4- DIPHENYL-1-ISOPROPYL-5-THIOXO-, ETHYL ESTER