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REL-(2R,4S,6S,8R)-2,4,6,8-TETRAKIS-(4-METHYLPHENYL)-3,7-DIAZABICYCLO-[3.3.1]-NONAN-9-ONE
SpectraBase Compound ID 6dgt2MIH4Tb
InChI InChI=1S/C35H36N2O/c1-21-5-13-25(14-6-21)31-29-32(26-15-7-22(2)8-16-26)37-34(28-19-11-24(4)12-20-28)30(35(29)38)33(36-31)27-17-9-23(3)10-18-27/h5-20,29-34,36-37H,1-4H3/t29-,30+,31-,32-,33+,34+
InChIKey ZXBIKBZGIDVZNP-DAPMWJFYSA-N
Mol Weight 500.7 g/mol
Molecular Formula C35H36N2O
Exact Mass 500.282764 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DqgKlenfHbI
Name REL-(2R,4S,6S,8R)-2,4,6,8-TETRAKIS-(4-METHYLPHENYL)-3,7-DIAZABICYCLO-[3.3.1]-NONAN-9-ONE
Compound Number 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H36N2O
InChI InChI=1S/C35H36N2O/c1-21-5-13-25(14-6-21)31-29-32(26-15-7-22(2)8-16-26)37-34(28-19-11-24(4)12-20-28)30(35(29)38)33(36-31)27-17-9-23(3)10-18-27/h5-20,29-34,36-37H,1-4H3/t29-,30+,31-,32-,33+,34+
InChIKey ZXBIKBZGIDVZNP-DAPMWJFYSA-N
Literature Reference Author L.M.JACKMAN,T.S.DUNNE,B.MUELLER,H.QUAST
Literature Reference Citation CHEM.BER.,115,2872(1982)
Literature Reference DOI 10.1002/cber.19821150818
Molecular Weight 500.684 g/mol
Solvent CDCl3
Source File Reference UWCS5860