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(2SR,6RS,7RS)-(+/-)-4-DIBUTYLAMINO-6,7-DIPHENYLBICYCLO-[2.2.2]-OCTAN-2-OL
SpectraBase Compound ID 679jPjCvfHz
InChI InChI=1S/C28H39NO/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/h7-16,24-27,30H,3-6,17-21H2,1-2H3/t24-,25-,26-,27-,28-/m1/s1
InChIKey OGPCWWKVFHYFJS-JQPIIJRMSA-N
Mol Weight 405.6 g/mol
Molecular Formula C28H39NO
Exact Mass 405.303165 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6OmErYWvjC6
Name (2SR,6RS,7RS)-(+/-)-4-DIBUTYLAMINO-6,7-DIPHENYLBICYCLO-[2.2.2]-OCTAN-2-OL
Compound Number 2H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H39NO
InChI InChI=1S/C28H39NO/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/h7-16,24-27,30H,3-6,17-21H2,1-2H3/t24-,25-,26-,27-,28-/m1/s1
InChIKey OGPCWWKVFHYFJS-JQPIIJRMSA-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 405.624 g/mol
Solvent CDCl3
Source File Reference UWSI23576