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4,8,9,10-TETRAKIS-(4-METHYLPHEYL)-1,3-DIAZAADAMANTANE

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4,8,9,10-TETRAKIS-(4-METHYLPHEYL)-1,3-DIAZAADAMANTANE
SpectraBase Compound ID 7c6S3CZOQAd
InChI InChI=1S/C36H38N2/c1-23-5-13-27(14-6-23)33-31-21-32-35(29-17-9-25(3)10-18-29)37(33)22-38(34(31)28-15-7-24(2)8-16-28)36(32)30-19-11-26(4)12-20-30/h5-20,31-36H,21-22H2,1-4H3/t31-,32+,33-,34+,35+,36-
InChIKey QTAKCOXDBYIHEE-MUOCCTLHSA-N
Mol Weight 498.7 g/mol
Molecular Formula C36H38N2
Exact Mass 498.303499 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LUBXJFKfsDh
Name 4,8,9,10-TETRAKIS-(4-METHYLPHEYL)-1,3-DIAZAADAMANTANE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H38N2
InChI InChI=1S/C36H38N2/c1-23-5-13-27(14-6-23)33-31-21-32-35(29-17-9-25(3)10-18-29)37(33)22-38(34(31)28-15-7-24(2)8-16-28)36(32)30-19-11-26(4)12-20-30/h5-20,31-36H,21-22H2,1-4H3/t31-,32+,33-,34+,35+,36-
InChIKey QTAKCOXDBYIHEE-MUOCCTLHSA-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 498.711 g/mol
Solvent CDCl3
Source File Reference UWCS5854