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2,4,6,8-TETRA-(3,5-DIMETHYLPHENYL)-7-METHYL-3,7-DIAZABICYCLO-[3.3.1]-NONAN-9-ONE

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2,4,6,8-TETRA-(3,5-DIMETHYLPHENYL)-7-METHYL-3,7-DIAZABICYCLO-[3.3.1]-NONAN-9-ONE
SpectraBase Compound ID 5mFLHDEnKai
InChI InChI=1S/C40H46N2O/c1-22-10-23(2)15-30(14-22)36-34-38(32-18-26(5)12-27(6)19-32)42(9)39(33-20-28(7)13-29(8)21-33)35(40(34)43)37(41-36)31-16-24(3)11-25(4)17-31/h10-21,34-39,41H,1-9H3/t34-,35-,36+,37+,38-,39+/m0/s1
InChIKey JMADOLAKMXVKLU-KWLJYUEXSA-N
Mol Weight 570.8 g/mol
Molecular Formula C40H46N2O
Exact Mass 570.361014 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ACj6XLlHyyu
Name 2,4,6,8-TETRA-(3,5-DIMETHYLPHENYL)-7-METHYL-3,7-DIAZABICYCLO-[3.3.1]-NONAN-9-ONE
Compound Number 2G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H46N2O
InChI InChI=1S/C40H46N2O/c1-22-10-23(2)15-30(14-22)36-34-38(32-18-26(5)12-27(6)19-32)42(9)39(33-20-28(7)13-29(8)21-33)35(40(34)43)37(41-36)31-16-24(3)11-25(4)17-31/h10-21,34-39,41H,1-9H3/t34-,35-,36+,37+,38-,39+/m0/s1
InChIKey JMADOLAKMXVKLU-KWLJYUEXSA-N
Literature Reference Author V.VIJAYAKUMAR,M.SUNDARAVADIVELU,S.PERUMAL
Literature Reference Citation MAGN.RES.CHEM.,39,101(2001)
Literature Reference DOI 10.1002/1097-458x(200102)39:2<101::aid-mrc797>3.0.co;2-f
Molecular Weight 570.818 g/mol
Solvent CDCl3
Source File Reference UWSI24824