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(7RS,8RS)-(+/-)-2-(7,8-DIPHENYL-5-PIPERIDINO-2-AZABICYCLO-[3.2.2]-NON-2-YL)-ETHYL-ISONICOTINATE
SpectraBase Compound ID 2geXi8mN0Za
InChI InChI=1S/C33H39N3O2/c37-32(28-14-17-34-18-15-28)38-23-22-35-21-16-33(36-19-8-3-9-20-36)24-29(26-10-4-1-5-11-26)31(35)30(25-33)27-12-6-2-7-13-27/h1-2,4-7,10-15,17-18,29-31H,3,8-9,16,19-25H2/t29-,30-,31-,33-/m0/s1
InChIKey JTRGNKZEWYTRSC-QUUJSONZSA-N
Mol Weight 509.7 g/mol
Molecular Formula C33H39N3O2
Exact Mass 509.304228 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ISPA6kMefn4
Name (7RS,8RS)-(+/-)-2-(7,8-DIPHENYL-5-PIPERIDINO-2-AZABICYCLO-[3.2.2]-NON-2-YL)-ETHYL-ISONICOTINATE
Compound Number 6D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H39N3O2
InChI InChI=1S/C33H39N3O2/c37-32(28-14-17-34-18-15-28)38-23-22-35-21-16-33(36-19-8-3-9-20-36)24-29(26-10-4-1-5-11-26)31(35)30(25-33)27-12-6-2-7-13-27/h1-2,4-7,10-15,17-18,29-31H,3,8-9,16,19-25H2/t29-,30-,31-,33-/m0/s1
InChIKey JTRGNKZEWYTRSC-QUUJSONZSA-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 509.692 g/mol
Sample ID 68512
Solvent CDCl3