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CONE-5,11,17-TRIS-(2,2-DIBROMOETHENYL)-23-FORMYL-25,26,27,28-TETRA-N-PROPOXYCALIX-[4]-ARENE
SpectraBase Compound ID E2Ty3wUP6mt
InChI InChI=1S/C47H48Br6O5/c1-5-9-55-44-33-13-29(21-41(48)49)14-34(44)25-36-16-31(23-43(52)53)18-38(46(36)57-11-7-3)27-40-20-32(28-54)19-39(47(40)58-12-8-4)26-37-17-30(22-42(50)51)15-35(24-33)45(37)56-10-6-2/h13-23,28H,5-12,24-27H2,1-4H3
InChIKey NXIRRAZEZUPEKP-UHFFFAOYSA-N
Mol Weight 1172.3 g/mol
Molecular Formula C47H48Br6O5
Exact Mass 1165.860203 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4DOI9jEiMNd
Name CONE-5,11,17-TRIS-(2,2-DIBROMOETHENYL)-23-FORMYL-25,26,27,28-TETRA-N-PROPOXYCALIX-[4]-ARENE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C47H48Br6O5
InChI InChI=1S/C47H48Br6O5/c1-5-9-55-44-33-13-29(21-41(48)49)14-34(44)25-36-16-31(23-43(52)53)18-38(46(36)57-11-7-3)27-40-20-32(28-54)19-39(47(40)58-12-8-4)26-37-17-30(22-42(50)51)15-35(24-33)45(37)56-10-6-2/h13-23,28H,5-12,24-27H2,1-4H3
InChIKey NXIRRAZEZUPEKP-UHFFFAOYSA-N
Literature Reference Author G.DYKER,M.MASTALERZ,I.M.MUELLER
Literature Reference Citation EUR.J.ORG.CHEM.,3801(2005)
Molecular Weight 1172.319 g/mol
Sample ID 30435
Solvent CDCl3