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37,38,39,40,41,42-HEXAKIS-(4-AMINOBUTOXY)-CALIX-[6]-ARENE
SpectraBase Compound ID CZa42Jp11VP
InChI InChI=1S/C66H90N6O6/c67-31-1-7-37-73-61-49-19-13-20-50(61)44-52-22-15-24-54(63(52)75-39-9-3-33-69)46-56-26-17-28-58(65(56)77-41-11-5-35-71)48-60-30-18-29-59(66(60)78-42-12-6-36-72)47-57-27-16-25-55(64(57)76-40-10-4-34-70)45-53-23-14-21-51(43-49)62(53)74-38-8-2-32-68/h13-30H,1-12,31-48,67-72H2
InChIKey WUTQBEJBSUWSLK-UHFFFAOYSA-N
Mol Weight 1063.5 g/mol
Molecular Formula C66H90N6O6
Exact Mass 1062.692185 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ITGMk0QKyAy
Name 37,38,39,40,41,42-HEXAKIS-(4-AMINOBUTOXY)-CALIX-[6]-ARENE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C66H90N6O6
InChI InChI=1S/C66H90N6O6/c67-31-1-7-37-73-61-49-19-13-20-50(61)44-52-22-15-24-54(63(52)75-39-9-3-33-69)46-56-26-17-28-58(65(56)77-41-11-5-35-71)48-60-30-18-29-59(66(60)78-42-12-6-36-72)47-57-27-16-25-55(64(57)76-40-10-4-34-70)45-53-23-14-21-51(43-49)62(53)74-38-8-2-32-68/h13-30H,1-12,31-48,67-72H2
InChIKey WUTQBEJBSUWSLK-UHFFFAOYSA-N
Literature Reference Author A.CASNATI,N.D.CA,M.FONTANELLA,F.SANSONE,F.UGOZZOLI,R.UNGARO, K.LIGER,J.F.DOZOL
Literature Reference Citation EUR.J.ORG.CHEM.,2338(2005)
Molecular Weight 1063.477 g/mol
Sample ID 39350
Solvent CDCl3