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1,6-(DIPHENYLMETHYLENIUM)-PYRENE-DICATION

View entire compound with spectra: 2 NMR

1,6-(DIPHENYLMETHYLENIUM)-PYRENE-DICATION
SpectraBase Compound ID Hxp3Xgqtocy
InChI InChI=1S/C42H30/c1-5-13-29(14-6-1)39(30-15-7-2-8-16-30)35-25-21-33-24-28-38-36(26-22-34-23-27-37(35)41(33)42(34)38)40(31-17-9-3-10-18-31)32-19-11-4-12-20-32/h1-28,39-40H
InChIKey DCGXECVPJQCJTB-UHFFFAOYSA-N
Mol Weight 534.7 g/mol
Molecular Formula C42H30
Exact Mass 534.234751 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 74NDS5Uejkt
Name 1,6-(DIPHENYLMETHYLENIUM)-PYRENE-DICATION
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H30
InChI InChI=1S/C42H30/c1-5-13-29(14-6-1)39(30-15-7-2-8-16-30)35-25-21-33-24-28-38-36(26-22-34-23-27-37(35)41(33)42(34)38)40(31-17-9-3-10-18-31)32-19-11-4-12-20-32/h1-28,39-40H
InChIKey DCGXECVPJQCJTB-UHFFFAOYSA-N
Literature Reference Author P.E.HANSEN,J.SPANGET-LARSEN,K.K.LAALI
Literature Reference Citation J.ORG.CHEM.,63,1827(1998)
Literature Reference DOI 10.1021/jo9715480
Molecular Weight 534.700 g/mol
Sample ID 28012
Solvent SO2ClF