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1,4-BIS-[TRIS-(4'-ETHYNYLPHENYL)-METHYL]-BENZENE
SpectraBase Compound ID KjsiEUQAH9P
InChI InChI=1S/C56H34/c1-7-41-13-25-47(26-14-41)55(48-27-15-42(8-2)16-28-48,49-29-17-43(9-3)18-30-49)53-37-39-54(40-38-53)56(50-31-19-44(10-4)20-32-50,51-33-21-45(11-5)22-34-51)52-35-23-46(12-6)24-36-52/h1-6,13-40H
InChIKey RSQZWYWVIBQABE-UHFFFAOYSA-N
Mol Weight 706.9 g/mol
Molecular Formula C56H34
Exact Mass 706.266051 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 93W4fqdiktD
Name 1,4-BIS-[TRIS-(4'-ETHYNYLPHENYL)-METHYL]-BENZENE
Compound Number 2-CCH
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C56H34
InChI InChI=1S/C56H34/c1-7-41-13-25-47(26-14-41)55(48-27-15-42(8-2)16-28-48,49-29-17-43(9-3)18-30-49)53-37-39-54(40-38-53)56(50-31-19-44(10-4)20-32-50,51-33-21-45(11-5)22-34-51)52-35-23-46(12-6)24-36-52/h1-6,13-40H
InChIKey RSQZWYWVIBQABE-UHFFFAOYSA-N
Literature Reference Author O.PLIETZSCH,A.SCHADE,A.HAFNER,J.HUUSKONEN,K.RISSANEN,M.NIEGE R,T.MULLER,S.BRAESE
Literature Reference Citation EUR.J.ORG.CHEM.,2013,283(2013)
Literature Reference DOI 10.1002/ejoc.201201162
Molecular Weight 706.886 g/mol
Solvent CDCl3
Source File Reference UWBT17409