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(7RS,8RS)-(+/-)-2-(BIPHENYL-4-SULFONYL)-7,8-DIPHENYL-5-PIPERIDINO-2-AZABICYCLO-[3.2.2]-NONANE
SpectraBase Compound ID IbXzEHPJcvf
InChI InChI=1S/C37H40N2O2S/c40-42(41,33-21-19-30(20-22-33)29-13-5-1-6-14-29)39-26-23-37(38-24-11-4-12-25-38)27-34(31-15-7-2-8-16-31)36(39)35(28-37)32-17-9-3-10-18-32/h1-3,5-10,13-22,34-36H,4,11-12,23-28H2/t34-,35-,36-,37-/m0/s1
InChIKey QJFGIOGOAMAUSX-BQYLNSIHSA-N
Mol Weight 576.8 g/mol
Molecular Formula C37H40N2O2S
Exact Mass 576.28105 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9no2TEV7fH5
Name (7RS,8RS)-(+/-)-2-(BIPHENYL-4-SULFONYL)-7,8-DIPHENYL-5-PIPERIDINO-2-AZABICYCLO-[3.2.2]-NONANE
Compound Number 9D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H40N2O2S
InChI InChI=1S/C37H40N2O2S/c40-42(41,33-21-19-30(20-22-33)29-13-5-1-6-14-29)39-26-23-37(38-24-11-4-12-25-38)27-34(31-15-7-2-8-16-31)36(39)35(28-37)32-17-9-3-10-18-32/h1-3,5-10,13-22,34-36H,4,11-12,23-28H2/t34-,35-,36-,37-/m0/s1
InChIKey QJFGIOGOAMAUSX-BQYLNSIHSA-N
Literature Reference Author W.SEEBACHER,M.KAISER,R.BRUN,R.SAF,R.WEIS
Literature Reference Citation MH.CHEM.,138,619(2007)
Literature Reference DOI 10.1007/s00706-007-0634-1
Molecular Weight 576.797 g/mol
Sample ID 68519
Solvent CDCl3