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(6RS,7RS)-(+/-)-4-DIBUTYLAMINO-6,7-DIPHENYLBICYCLO-[2.2.2]-OCTAN-2-ONE
SpectraBase Compound ID Gg9hTEPDME9
InChI InChI=1S/C28H37NO/c1-3-5-17-29(18-6-4-2)28-19-24(22-13-9-7-10-14-22)27(26(30)21-28)25(20-28)23-15-11-8-12-16-23/h7-16,24-25,27H,3-6,17-21H2,1-2H3/t24-,25-,27-,28-/m1/s1
InChIKey CEXIRRLGEOXXHG-CDRKEARJSA-N
Mol Weight 403.6 g/mol
Molecular Formula C28H37NO
Exact Mass 403.287515 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3BsmPyqpEPH
Name (6RS,7RS)-(+/-)-4-DIBUTYLAMINO-6,7-DIPHENYLBICYCLO-[2.2.2]-OCTAN-2-ONE
Compound Number 1H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H37NO
InChI InChI=1S/C28H37NO/c1-3-5-17-29(18-6-4-2)28-19-24(22-13-9-7-10-14-22)27(26(30)21-28)25(20-28)23-15-11-8-12-16-23/h7-16,24-25,27H,3-6,17-21H2,1-2H3/t24-,25-,27-,28-/m1/s1
InChIKey CEXIRRLGEOXXHG-CDRKEARJSA-N
Literature Reference Author W.SEEBACHER,M.KAISER,R.BRUN,R.SAF,R.WEIS
Literature Reference Citation MH.CHEM.,136,625(2005)
Literature Reference DOI 10.1007/s00706-004-0264-9
Molecular Weight 403.608 g/mol
Solvent CDCl3
Source File Reference UWSI23573