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TETRAETHYL-4,4',4'',4'''-[[METHANETETRAETHYL-TETRAKIS-(PHENYLENE-4,1-DIYL)]-TETRAKIS-(ETHYNE-2,1-DIYL)]-TETRABENZOATE
SpectraBase Compound ID 4hYXCELta38
InChI InChI=1S/C69H52O8/c1-5-74-65(70)57-33-17-49(18-34-57)9-13-53-25-41-61(42-26-53)69(62-43-27-54(28-44-62)14-10-50-19-35-58(36-20-50)66(71)75-6-2,63-45-29-55(30-46-63)15-11-51-21-37-59(38-22-51)67(72)76-7-3)64-47-31-56(32-48-64)16-12-52-23-39-60(40-24-52)68(73)77-8-4/h17-48H,5-8H2,1-4H3
InChIKey NIKIFLUUPKCHHW-UHFFFAOYSA-N
Mol Weight 1009.2 g/mol
Molecular Formula C69H52O8
Exact Mass 1008.366219 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LFdMs9eYCmI
Name TETRAETHYL-4,4',4'',4'''-[[METHANETETRAETHYL-TETRAKIS-(PHENYLENE-4,1-DIYL)]-TETRAKIS-(ETHYNE-2,1-DIYL)]-TETRABENZOATE
Compound Number 10C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C69H52O8
InChI InChI=1S/C69H52O8/c1-5-74-65(70)57-33-17-49(18-34-57)9-13-53-25-41-61(42-26-53)69(62-43-27-54(28-44-62)14-10-50-19-35-58(36-20-50)66(71)75-6-2,63-45-29-55(30-46-63)15-11-51-21-37-59(38-22-51)67(72)76-7-3)64-47-31-56(32-48-64)16-12-52-23-39-60(40-24-52)68(73)77-8-4/h17-48H,5-8H2,1-4H3
InChIKey NIKIFLUUPKCHHW-UHFFFAOYSA-N
Literature Reference Author C.I.SCHILLING,O.PLIETZSCH,M.NIEGER,T.MULLER,S.BRAESE
Literature Reference Citation EUR.J.ORG.CHEM.,2011,1743(2011)
Literature Reference DOI 10.1002/ejoc.201001567
Molecular Weight 1009.167 g/mol
Solvent CDCl3
Source File Reference UWBT20858