For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
TETRAETHYL-4,4',4'',4'''-[[ADAMANTANE-1,3,5,7-TETRAYL-TETRAKIS-(PHENYLENE-4,1-DIYL)]-TETRAKIS-(ETHYNE-2,1-DIYL)]-TETRABENZOATE
SpectraBase Compound ID FJPRRJ0AaBP
InChI InChI=1S/C78H64O8/c1-5-83-71(79)63-33-17-55(18-34-63)9-13-59-25-41-67(42-26-59)75-49-76(68-43-27-60(28-44-68)14-10-56-19-35-64(36-20-56)72(80)84-6-2)52-77(50-75,69-45-29-61(30-46-69)15-11-57-21-37-65(38-22-57)73(81)85-7-3)54-78(51-75,53-76)70-47-31-62(32-48-70)16-12-58-23-39-66(40-24-58)74(82)86-8-4/h17-48H,5-8,49-54H2,1-4H3/t75-,76+,77-,78+
InChIKey SUQTUGNYNAIAGY-MLVYRVHLSA-N
Mol Weight 1129.4 g/mol
Molecular Formula C78H64O8
Exact Mass 1128.460119 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 92uQqNTiHDn
Name TETRAETHYL-4,4',4'',4'''-[[ADAMANTANE-1,3,5,7-TETRAYL-TETRAKIS-(PHENYLENE-4,1-DIYL)]-TETRAKIS-(ETHYNE-2,1-DIYL)]-TETRABENZOATE
Compound Number 11C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C78H64O8
InChI InChI=1S/C78H64O8/c1-5-83-71(79)63-33-17-55(18-34-63)9-13-59-25-41-67(42-26-59)75-49-76(68-43-27-60(28-44-68)14-10-56-19-35-64(36-20-56)72(80)84-6-2)52-77(50-75,69-45-29-61(30-46-69)15-11-57-21-37-65(38-22-57)73(81)85-7-3)54-78(51-75,53-76)70-47-31-62(32-48-70)16-12-58-23-39-66(40-24-58)74(82)86-8-4/h17-48H,5-8,49-54H2,1-4H3/t75-,76+,77-,78+
InChIKey SUQTUGNYNAIAGY-MLVYRVHLSA-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 1129.361 g/mol
Solvent CDCl3
Source File Reference UWBT20859