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(5S)-1,5-DIBENZYL-3-(4-NITROPHENYL)-PYRROLIDIN-2-ONE
SpectraBase Compound ID 5HeE01xu8wB
InChI InChI=1S/2C24H22N2O3/c2*27-24-23(20-11-13-21(14-12-20)26(28)29)16-22(15-18-7-3-1-4-8-18)25(24)17-19-9-5-2-6-10-19/h2*1-14,22-23H,15-17H2/t2*22-,23?/m00/s1
InChIKey ITSIINXFZXNZMF-ZPDZHZKKSA-N
Mol Weight 772.9 g/mol
Molecular Formula C48H44N4O6
Exact Mass 772.326085 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LGH2TWIEGGz
Name (5S)-1,5-DIBENZYL-3-(4-NITROPHENYL)-PYRROLIDIN-2-ONE
Compound Number 9A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H44N4O6
InChI InChI=1S/2C24H22N2O3/c2*27-24-23(20-11-13-21(14-12-20)26(28)29)16-22(15-18-7-3-1-4-8-18)25(24)17-19-9-5-2-6-10-19/h2*1-14,22-23H,15-17H2/t2*22-,23?/m00/s1
InChIKey ITSIINXFZXNZMF-ZPDZHZKKSA-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 772.901 g/mol
Sample ID 34451
Solvent CDCl3