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(4R,2'S,4'R)-DIETHYL-2-(4'-ETHOXYCARBONYL-2'-THIAZOLIDINYL)-6-METHYL-4-(THIEN-2''-YL)-1,4-DIHYDROPYRIDINE-3,5-DICARBOXYLATE
SpectraBase Compound ID FXRkrQGx8jC
InChI InChI=1S/C22H28N2O6S2/c1-5-28-20(25)13-11-32-19(24-13)18-17(22(27)30-7-3)16(14-9-8-10-31-14)15(12(4)23-18)21(26)29-6-2/h8-10,13,16,19,23-24H,5-7,11H2,1-4H3/t13-,16+,19-/m0/s1
InChIKey YSHVSFRJWXVDLZ-CRFBAAHOSA-N
Mol Weight 480.59 g/mol
Molecular Formula C22H28N2O6S2
Exact Mass 480.138879 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AFRBRG9bsi3
Name (4R,2'S,4'R)-DIETHYL-2-(4'-ETHOXYCARBONYL-2'-THIAZOLIDINYL)-6-METHYL-4-(THIEN-2''-YL)-1,4-DIHYDROPYRIDINE-3,5-DICARBOXYLATE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H28N2O6S2
InChI InChI=1S/C22H28N2O6S2/c1-5-28-20(25)13-11-32-19(24-13)18-17(22(27)30-7-3)16(14-9-8-10-31-14)15(12(4)23-18)21(26)29-6-2/h8-10,13,16,19,23-24H,5-7,11H2,1-4H3/t13-,16+,19-/m0/s1
InChIKey YSHVSFRJWXVDLZ-CRFBAAHOSA-N
Literature Reference Author S.MARCHALIN,K.CVOPOVA,M.KRIZ,P.BARAN,H.OULYADI,A.DAICH
Literature Reference Citation J.ORG.CHEM.,69,4227(2004)
Literature Reference DOI 10.1021/jo049706s
Molecular Weight 480.594 g/mol
Solvent CDCl3
Source File Reference UWVN21694