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1,3,5-TRIMETHYL-2,4-BIS-(2,6-DIFLUOROPHENYL)-3-AZABICYCLO-[3.3.1]-NONAN-9-ONE

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1,3,5-TRIMETHYL-2,4-BIS-(2,6-DIFLUOROPHENYL)-3-AZABICYCLO-[3.3.1]-NONAN-9-ONE
SpectraBase Compound ID 7Bou2MtLNLJ
InChI InChI=1S/C23H23F4NO/c1-22-11-6-12-23(2,21(22)29)20(18-15(26)9-5-10-16(18)27)28(3)19(22)17-13(24)7-4-8-14(17)25/h4-5,7-10,19-20H,6,11-12H2,1-3H3/t19-,20-,22-,23+/m1/s1
InChIKey MXARVVLVZVXTPY-PRTQVNTJSA-N
Mol Weight 405.44 g/mol
Molecular Formula C23H23F4NO
Exact Mass 405.171577 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CKy3tpcSbae
Name 1,3,5-TRIMETHYL-2,4-BIS-(2,6-DIFLUOROPHENYL)-3-AZABICYCLO-[3.3.1]-NONAN-9-ONE
Compound Number 7B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H23F4NO
InChI InChI=1S/C23H23F4NO/c1-22-11-6-12-23(2,21(22)29)20(18-15(26)9-5-10-16(18)27)28(3)19(22)17-13(24)7-4-8-14(17)25/h4-5,7-10,19-20H,6,11-12H2,1-3H3/t19-,20-,22-,23+/m1/s1
InChIKey MXARVVLVZVXTPY-PRTQVNTJSA-N
Literature Reference Author M.PHAM,M.GDANIEC,T.POLONSKI
Literature Reference Citation J.ORG.CHEM.,63,3731(1998)
Literature Reference DOI 10.1021/jo9800457
Molecular Weight 405.435 g/mol
Sample ID 37338
Solvent CDCl3