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RAC-CONE-33,34,35,36-TETRAKIS-(PROPYLOXY)-CALIX-[3]-BENZENE-[1]-PHENANTHRENE

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RAC-CONE-33,34,35,36-TETRAKIS-(PROPYLOXY)-CALIX-[3]-BENZENE-[1]-PHENANTHRENE
SpectraBase Compound ID FSemQd6RWuk
InChI InChI=1S/2C48H52O4/c2*1-5-24-49-45-35-15-11-16-36(45)30-38-18-13-20-40(47(38)51-26-7-3)32-43-44-34(23-22-33-14-9-10-21-42(33)44)28-41(48(43)52-27-8-4)31-39-19-12-17-37(29-35)46(39)50-25-6-2/h2*9-23,28H,5-8,24-27,29-32H2,1-4H3
InChIKey GUXFKPMZWZDVRH-UHFFFAOYSA-N
Mol Weight 1385.9 g/mol
Molecular Formula C96H104O8
Exact Mass 1384.77312 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 91WcO1cA2YY
Name RAC-CONE-33,34,35,36-TETRAKIS-(PROPYLOXY)-CALIX-[3]-BENZENE-[1]-PHENANTHRENE
Compound Number 13A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C96H104O8
InChI InChI=1S/2C48H52O4/c2*1-5-24-49-45-35-15-11-16-36(45)30-38-18-13-20-40(47(38)51-26-7-3)32-43-44-34(23-22-33-14-9-10-21-42(33)44)28-41(48(43)52-27-8-4)31-39-19-12-17-37(29-35)46(39)50-25-6-2/h2*9-23,28H,5-8,24-27,29-32H2,1-4H3
InChIKey GUXFKPMZWZDVRH-UHFFFAOYSA-N
Literature Reference Author M.MASTALERZ,W.HUEGGENBERG,G.DYKER
Literature Reference Citation EUR.J.ORG.CHEM.,3977(2006)
Molecular Weight 1385.877 g/mol
Sample ID 44654
Solvent CDCl3