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2,4-DIPYRIDIN-2-YL-3,7-DIMETHYL-3,7-DIAZABICYCLO-[3.3.1]-NONAN-9-ONE-1,5-DIESTER
SpectraBase Compound ID KhMLXgt6isU
InChI InChI=1S/C23H26N4O5/c1-26-13-22(20(29)31-3)17(15-9-5-7-11-24-15)27(2)18(16-10-6-8-12-25-16)23(14-26,19(22)28)21(30)32-4/h5-12,17-18H,13-14H2,1-4H3/t17-,18-,22-,23+/m1/s1
InChIKey NXOACBKUEYYEQP-GGILJOMBSA-N
Mol Weight 438.48 g/mol
Molecular Formula C23H26N4O5
Exact Mass 438.19032 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FUcHnYdXGau
Name 2,4-DIPYRIDIN-2-YL-3,7-DIMETHYL-3,7-DIAZABICYCLO-[3.3.1]-NONAN-9-ONE-1,5-DIESTER
Compound Number HZ2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H26N4O5
InChI InChI=1S/C23H26N4O5/c1-26-13-22(20(29)31-3)17(15-9-5-7-11-24-15)27(2)18(16-10-6-8-12-25-16)23(14-26,19(22)28)21(30)32-4/h5-12,17-18H,13-14H2,1-4H3/t17-,18-,22-,23+/m1/s1
InChIKey NXOACBKUEYYEQP-GGILJOMBSA-N
Literature Reference Author U.KUHL,A.CAMBARERI,C.SAUBER,F.SOERGEL,R.HARTMANN,H.EULER,A.K IRFEL,U.HOLZGRABE
Literature Reference Citation J.CHEM.SOC.PERKIN-2,2083(1999)
Literature Reference DOI 10.1039/a904472h
Molecular Weight 438.483 g/mol
Solvent DMSO-D6
Source File Reference UWRU11003