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2,6-BIS-[[1-(1,3-DIOXOLAN-2-YL)-PYRIDINIUM]-METHYL]-TOLUENE-BIS-(TERTAFLUOROBORATE)

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2,6-BIS-[[1-(1,3-DIOXOLAN-2-YL)-PYRIDINIUM]-METHYL]-TOLUENE-BIS-(TERTAFLUOROBORATE)
SpectraBase Compound ID Dn3Q39yDhAN
InChI InChI=1S/C25H28N2O4.2BF4/c1-19-20(17-26-11-4-2-9-22(26)24-28-13-14-29-24)7-6-8-21(19)18-27-12-5-3-10-23(27)25-30-15-16-31-25;2*2-1(3,4)5/h2-12,24-25H,13-18H2,1H3;;/q+2;2*-1
InChIKey FKBJPYIUCAOXRA-UHFFFAOYSA-N
Mol Weight 594.1 g/mol
Molecular Formula C25H28B2F8N2O4
Exact Mass 594.210743 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EOS8IVqg6Pn
Name 2,6-BIS-[[1-(1,3-DIOXOLAN-2-YL)-PYRIDINIUM]-METHYL]-TOLUENE-BIS-(TERTAFLUOROBORATE)
Compound Number 3B(2BF4)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H28B2F8N2O4
InChI InChI=1S/C25H28N2O4.2BF4/c1-19-20(17-26-11-4-2-9-22(26)24-28-13-14-29-24)7-6-8-21(19)18-27-12-5-3-10-23(27)25-30-15-16-31-25;2*2-1(3,4)5/h2-12,24-25H,13-18H2,1H3;;/q+2;2*-1
InChIKey FKBJPYIUCAOXRA-UHFFFAOYSA-N
Literature Reference Author A.GRANZHAN,H.IHMELS,K.MIKHLINA,H.J.DEISEROTH,H.MIKUS
Literature Reference Citation EUR.J.ORG.CHEM.,4098(2005)
Molecular Weight 594.116 g/mol
Sample ID 41297
Solvent DMSO-D6