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OCTAMETHYL-5,5',5'',5'''-[[METHANETETRAYL-TETRAKIS-(PHENYLENE-4,1-DIYL)]-TETRAKIS-(ETHYNE-2,1-DIYL)]-TETRAISOPHTHALATE
SpectraBase Compound ID AvquH4HR0Q7
InChI InChI=1S/C73H52O16/c1-82-65(74)53-33-49(34-54(41-53)66(75)83-2)13-9-45-17-25-61(26-18-45)73(62-27-19-46(20-28-62)10-14-50-35-55(67(76)84-3)42-56(36-50)68(77)85-4,63-29-21-47(22-30-63)11-15-51-37-57(69(78)86-5)43-58(38-51)70(79)87-6)64-31-23-48(24-32-64)12-16-52-39-59(71(80)88-7)44-60(40-52)72(81)89-8/h17-44H,1-8H3
InChIKey KHJHSOCUJJYWFB-UHFFFAOYSA-N
Mol Weight 1185.2 g/mol
Molecular Formula C73H52O16
Exact Mass 1184.325536 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D0l2SFtSuLk
Name OCTAMETHYL-5,5',5'',5'''-[[METHANETETRAYL-TETRAKIS-(PHENYLENE-4,1-DIYL)]-TETRAKIS-(ETHYNE-2,1-DIYL)]-TETRAISOPHTHALATE
Compound Number 10D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C73H52O16
InChI InChI=1S/C73H52O16/c1-82-65(74)53-33-49(34-54(41-53)66(75)83-2)13-9-45-17-25-61(26-18-45)73(62-27-19-46(20-28-62)10-14-50-35-55(67(76)84-3)42-56(36-50)68(77)85-4,63-29-21-47(22-30-63)11-15-51-37-57(69(78)86-5)43-58(38-51)70(79)87-6)64-31-23-48(24-32-64)12-16-52-39-59(71(80)88-7)44-60(40-52)72(81)89-8/h17-44H,1-8H3
InChIKey KHJHSOCUJJYWFB-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 1185.206 g/mol
Solvent CDCl3
Source File Reference UWBT20860