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CONE-5-[(2-PHENYL)-PHENYL]-25,26,27,28-TETRAKIS-(PROPYLOXY)-CALIX-[4]-ARENE

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CONE-5-[(2-PHENYL)-PHENYL]-25,26,27,28-TETRAKIS-(PROPYLOXY)-CALIX-[4]-ARENE
SpectraBase Compound ID 4n3OY12Gd7h
InChI InChI=1S/C52H56O4/c1-5-27-53-49-38-19-14-20-39(49)32-41-22-16-24-43(51(41)55-29-7-3)34-46-36-44(48-26-13-12-25-47(48)37-17-10-9-11-18-37)35-45(52(46)56-30-8-4)33-42-23-15-21-40(31-38)50(42)54-28-6-2/h9-26,35-36H,5-8,27-34H2,1-4H3
InChIKey XBJRZSJVORRFKO-UHFFFAOYSA-N
Mol Weight 745.0 g/mol
Molecular Formula C52H56O4
Exact Mass 744.41786 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LHVhjWSen37
Name CONE-5-[(2-PHENYL)-PHENYL]-25,26,27,28-TETRAKIS-(PROPYLOXY)-CALIX-[4]-ARENE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C52H56O4
InChI InChI=1S/C52H56O4/c1-5-27-53-49-38-19-14-20-39(49)32-41-22-16-24-43(51(41)55-29-7-3)34-46-36-44(48-26-13-12-25-47(48)37-17-10-9-11-18-37)35-45(52(46)56-30-8-4)33-42-23-15-21-40(31-38)50(42)54-28-6-2/h9-26,35-36H,5-8,27-34H2,1-4H3
InChIKey XBJRZSJVORRFKO-UHFFFAOYSA-N
Literature Reference Author M.MASTALERZ,G.DYKER,U.FLOERKE,G.HENKEL,I.O.OPPEL,K.MERZ
Literature Reference Citation EUR.J.ORG.CHEM.,4951(2006)
Molecular Weight 745.014 g/mol
Sample ID 44236
Solvent CDCl3