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5,11,17,23-TETRANITRO-25,27-BIS-(2-ETHOXYETHOXY)-26,28-BIS-(2-(2-(2-(2-(ADAMANTYL-1-OXY)-ETHOXY)-ETHOXY)-ETHOXY)-ETHOXY)-CALIX-[4]-ARENE
SpectraBase Compound ID 21Yuae0N1yy
InChI InChI=1S/C72H96N4O22/c1-3-85-13-19-93-67-55-31-59-39-65(75(81)82)41-61(69(59)95-21-15-89-9-5-87-7-11-91-17-23-97-71-43-49-25-50(44-71)27-51(26-49)45-71)33-57-37-64(74(79)80)38-58(68(57)94-20-14-86-4-2)34-62-42-66(76(83)84)40-60(32-56(67)36-63(35-55)73(77)78)70(62)96-22-16-90-10-6-88-8-12-92-18-24-98-72-46-52-28-53(47-72)30-54(29-52)48-72/h35-42,49-54H,3-34,43-48H2,1-2H3/t49-,50-,51-,52-,53+,54-,71-,72-
InChIKey JZVPWZRQDKRXOD-QVQWRACISA-N
Mol Weight 1369.6 g/mol
Molecular Formula C72H96N4O22
Exact Mass 1368.651621 g/mol
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Divalent Binding of a Bis(adamantyl)-Functionalized Calix[4]arene to β-cyclodextrin-based Hosts:  An Experimental and Theoretical Study on Multivalent Binding in Solution and at Self-Assembled Monolayers Journal of the American Chemical Society 2004
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