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CONE-5,11,17,23-TETRAKIS-(3-HYDROXY-3-METHYLBUT-1-YNYL)-25,26,27,28-TETRA-N-PROPOXYCALIX-[4]-ARENE
SpectraBase Compound ID 3rdiG2NJ2hf
InChI InChI=1S/C60H72O8/c1-13-25-65-53-45-29-41(17-21-57(5,6)61)30-46(53)38-48-32-43(19-23-59(9,10)63)34-50(55(48)67-27-15-3)40-52-36-44(20-24-60(11,12)64)35-51(56(52)68-28-16-4)39-49-33-42(18-22-58(7,8)62)31-47(37-45)54(49)66-26-14-2/h29-36,61-64H,13-16,25-28,37-40H2,1-12H3
InChIKey ZRFJPWUYDHMSLM-UHFFFAOYSA-N
Mol Weight 921.2 g/mol
Molecular Formula C60H72O8
Exact Mass 920.522719 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EE8Sqlr1RDn
Name CONE-5,11,17,23-TETRAKIS-(3-HYDROXY-3-METHYLBUT-1-YNYL)-25,26,27,28-TETRA-N-PROPOXYCALIX-[4]-ARENE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C60H72O8
InChI InChI=1S/C60H72O8/c1-13-25-65-53-45-29-41(17-21-57(5,6)61)30-46(53)38-48-32-43(19-23-59(9,10)63)34-50(55(48)67-27-15-3)40-52-36-44(20-24-60(11,12)64)35-51(56(52)68-28-16-4)39-49-33-42(18-22-58(7,8)62)31-47(37-45)54(49)66-26-14-2/h29-36,61-64H,13-16,25-28,37-40H2,1-12H3
InChIKey ZRFJPWUYDHMSLM-UHFFFAOYSA-N
Literature Reference Author G.DYKER,M.MASTALERZ,I.M.MUELLER
Literature Reference Citation EUR.J.ORG.CHEM.,3801(2005)
Molecular Weight 921.227 g/mol
Sample ID 30432
Solvent CDCl3