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3-[BIS-(4-CYANOPHENYL)-PHENYLMETHYL]-6-[BIS-(4-CYANOPHENYL)-METHYLENE]-1,4-CYCLOHEXADIENE
SpectraBase Compound ID 5ebV7UYBhaE
InChI InChI=1S/C42H26N4/c43-26-30-6-14-34(15-7-30)41(35-16-8-31(27-44)9-17-35)36-18-24-40(25-19-36)42(37-4-2-1-3-5-37,38-20-10-32(28-45)11-21-38)39-22-12-33(29-46)13-23-39/h1-25,40H
InChIKey QXIVGZWWCUYGRS-UHFFFAOYSA-N
Mol Weight 586.7 g/mol
Molecular Formula C42H26N4
Exact Mass 586.215747 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JN7ITVL6Go0
Name 3-[BIS-(4-CYANOPHENYL)-PHENYLMETHYL]-6-[BIS-(4-CYANOPHENYL)-METHYLENE]-1,4-CYCLOHEXADIENE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H26N4
InChI InChI=1S/C42H26N4/c43-26-30-6-14-34(15-7-30)41(35-16-8-31(27-44)9-17-35)36-18-24-40(25-19-36)42(37-4-2-1-3-5-37,38-20-10-32(28-45)11-21-38)39-22-12-33(29-46)13-23-39/h1-25,40H
InChIKey QXIVGZWWCUYGRS-UHFFFAOYSA-N
Literature Reference Author W.P.NEUMANN,A.PENENORY,U.STEWEN,M.LEHNIG
Literature Reference Citation J.AM.CHEM.SOC.,111,5845(1989)
Literature Reference DOI 10.1021/ja00197a053
Molecular Weight 586.695 g/mol
Solvent CDCl3
Source File Reference UWED10395