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N,N-DIFLUORO-5,5'-BIS-(TRIFLUOROMETHYL)-2,2'-BIPYRIDINIUM-BIS-(TRIFLUOROMETHANESULFONATE)
SpectraBase Compound ID EVK61EDucAO
InChI InChI=1S/C12H6F8N2.2CHF3O3S/c13-11(14,15)7-1-3-9(21(19)5-7)10-4-2-8(6-22(10)20)12(16,17)18;2*2-1(3,4)8(5,6)7/h1-6H;2*(H,5,6,7)/q+2;;/p-2
InChIKey PUZIKGZJVMFEGR-UHFFFAOYSA-L
Mol Weight 628.31 g/mol
Molecular Formula C14H6F14N2O6S2
Exact Mass 627.944373 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ae8kUsV3H1H
Name N,N-DIFLUORO-5,5'-BIS-(TRIFLUOROMETHYL)-2,2'-BIPYRIDINIUM-BIS-(TRIFLUOROMETHANESULFONATE)
Compound Number 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H6F14N2O6S2
InChI InChI=1S/C12H6F8N2.2CHF3O3S/c13-11(14,15)7-1-3-9(21(19)5-7)10-4-2-8(6-22(10)20)12(16,17)18;2*2-1(3,4)8(5,6)7/h1-6H;2*(H,5,6,7)/q+2;;/p-2
InChIKey PUZIKGZJVMFEGR-UHFFFAOYSA-L
Literature Reference Author T.UMEMOTO,M.NAGAYOSHI,K.ADACHI,G.TOMIZAWA
Literature Reference Citation J.ORG.CHEM.,63,3379(1998)
Literature Reference DOI 10.1021/jo972338q
Solvent CD3CN
Source File Reference UWLU37426