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1,3-BIS-[(3-METHYLIMIDAZOL-3-IUMYL)-METHYL]-2,4,6-TRIETHYLBENZENE-BIS-(HEXAFLUOROPHOSPHATE)

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1,3-BIS-[(3-METHYLIMIDAZOL-3-IUMYL)-METHYL]-2,4,6-TRIETHYLBENZENE-BIS-(HEXAFLUOROPHOSPHATE)
SpectraBase Compound ID 8wUm7K4vt6w
InChI InChI=1S/C21H27N6.3F6P/c1-22-4-7-25(16-22)13-19-10-20(14-26-8-5-23(2)17-26)12-21(11-19)15-27-9-6-24(3)18-27;3*1-7(2,3,4,5)6/h4-12,16-18H,13-15H2,1-3H3;;;/q+3;3*-1
InChIKey CSKSBNAXWDXBLE-UHFFFAOYSA-N
Mol Weight 798.38154294 g/mol
Molecular Formula C21H27F18N6P3
Exact Mass 798.122263 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DmUI5brUwoh
Name 1,3-BIS-[(3-METHYLIMIDAZOL-3-IUMYL)-METHYL]-2,4,6-TRIETHYLBENZENE-BIS-(HEXAFLUOROPHOSPHATE)
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H27F18N6P3
InChI InChI=1S/C21H27N6.3F6P/c1-22-4-7-25(16-22)13-19-10-20(14-26-8-5-23(2)17-26)12-21(11-19)15-27-9-6-24(3)18-27;3*1-7(2,3,4,5)6/h4-12,16-18H,13-15H2,1-3H3;;;/q+3;3*-1
InChIKey CSKSBNAXWDXBLE-UHFFFAOYSA-N
Literature Reference Author T.FAHLBUSCH,M.FRANK,J.SCHATZ,H.SCHMADERER
Literature Reference Citation EUR.J.ORG.CHEM.,1899(2006)
Molecular Weight 798.378 g/mol
Sample ID 31918
Solvent DMSO-D6