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ETHYL-(3RS,5R)-1,5-DIBENZYLPYRROLIDINE-2-ONE-3-CARBOXYLATE
SpectraBase Compound ID ELjd5mmwPvB
InChI InChI=1S/2C21H23NO3/c2*1-2-25-21(24)19-14-18(13-16-9-5-3-6-10-16)22(20(19)23)15-17-11-7-4-8-12-17/h2*3-12,18-19H,2,13-15H2,1H3/t18-,19+;18-,19-/m10/s1
InChIKey RLBZEDVHMCOOGU-PFJVEFKESA-N
Mol Weight 674.84 g/mol
Molecular Formula C42H46N2O6
Exact Mass 674.335587 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F2SfHoRCaFM
Name ETHYL-(3RS,5R)-1,5-DIBENZYLPYRROLIDINE-2-ONE-3-CARBOXYLATE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H46N2O6
InChI InChI=1S/2C21H23NO3/c2*1-2-25-21(24)19-14-18(13-16-9-5-3-6-10-16)22(20(19)23)15-17-11-7-4-8-12-17/h2*3-12,18-19H,2,13-15H2,1H3/t18-,19+;18-,19-/m10/s1
InChIKey RLBZEDVHMCOOGU-PFJVEFKESA-N
Literature Reference Author J.F.BOWER,J.SVENDA,A.J.WILLIAMS,J.P.H.CHARMANT,R.M.LAWRENCE, P.SZETO,T.GALLAGHER
Literature Reference Citation ORG.LETTERS,6,4727(2004)
Literature Reference DOI 10.1021/ol048036+
Molecular Weight 674.837 g/mol
Sample ID 34440
Solvent CDCl3