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(3R,6S)-1,6-DIBENZYL-3-METHYL-4-(PARA-TOLUENESULFONYL)-PIPERAZIN-2-ONE
SpectraBase Compound ID 2c5jUV8WWlW
InChI InChI=1S/C26H28N2O3S/c1-20-13-15-25(16-14-20)32(30,31)28-19-24(17-22-9-5-3-6-10-22)27(26(29)21(28)2)18-23-11-7-4-8-12-23/h3-16,21,24H,17-19H2,1-2H3/t21-,24+/m1/s1
InChIKey APRDUZMXGYJDJC-QPPBQGQZSA-N
Mol Weight 448.58 g/mol
Molecular Formula C26H28N2O3S
Exact Mass 448.182064 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F1EpHZW6A4k
Name (3R,6S)-1,6-DIBENZYL-3-METHYL-4-(PARA-TOLUENESULFONYL)-PIPERAZIN-2-ONE
Compound Number 7B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H28N2O3S
InChI InChI=1S/C26H28N2O3S/c1-20-13-15-25(16-14-20)32(30,31)28-19-24(17-22-9-5-3-6-10-22)27(26(29)21(28)2)18-23-11-7-4-8-12-23/h3-16,21,24H,17-19H2,1-2H3/t21-,24+/m1/s1
InChIKey APRDUZMXGYJDJC-QPPBQGQZSA-N
Literature Reference Author A.J.WILLIAMS,S.CHAKTHONG,D.GRAY,R.M.LAWRENCE,T.GALLAGHER
Literature Reference Citation ORG.LETTERS,5,811(2003)
Literature Reference DOI 10.1021/ol027418h
Molecular Weight 448.580 g/mol
Sample ID 47492
Solvent CDCl3