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3-(Bis[4-tert-butyl-phenyl]-phenyl-methyl)-6-(bis[4-tert-butyl-phenyl]-methylene)-1,4-cyclohexadiene

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3-(Bis[4-tert-butyl-phenyl]-phenyl-methyl)-6-(bis[4-tert-butyl-phenyl]-methylene)-1,4-cyclohexadiene
SpectraBase Compound ID EQIZA45cAY
InChI InChI=1S/C54H62/c1-50(2,3)41-24-18-38(19-25-41)49(39-20-26-42(27-21-39)51(4,5)6)40-22-28-46(29-23-40)54(45-16-14-13-15-17-45,47-34-30-43(31-35-47)52(7,8)9)48-36-32-44(33-37-48)53(10,11)12/h13-37,46H,1-12H3
InChIKey KMUNHNXTDQAJSI-UHFFFAOYSA-N
Mol Weight 711.1 g/mol
Molecular Formula C54H62
Exact Mass 710.485152 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8iP6ddUnAd7
Name 3-(Bis[4-tert-butyl-phenyl]-phenyl-methyl)-6-(bis[4-tert-butyl-phenyl]-methylene)-1,4-cyclohexadiene
CAS Registry Number 102343-00-0
Comments SHIFTCORRECTION: -3.0 PPM (A.H.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C54H62
InChI InChI=1S/C54H62/c1-50(2,3)41-24-18-38(19-25-41)49(39-20-26-42(27-21-39)51(4,5)6)40-22-28-46(29-23-40)54(45-16-14-13-15-17-45,47-34-30-43(31-35-47)52(7,8)9)48-36-32-44(33-37-48)53(10,11)12/h13-37,46H,1-12H3
InChIKey KMUNHNXTDQAJSI-UHFFFAOYSA-N
Instrument Name Bruker AM-300
Literature Reference W.P. Neumann, W. Uzick, A.K. Zarkadis, J. Am. Chem. Soc. 108, 3762 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4