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N-PENTAFLUOROPHENYL[ALPHA-(4-DIMETHYLAMINOPYRIDINIUM)]BENZIMIDECHLORIDE
SpectraBase Compound ID BeoxNGiuUWj
InChI InChI=1S/C20H15F5N3.ClH/c1-27(2)13-8-10-28(11-9-13)20(12-6-4-3-5-7-12)26-19-17(24)15(22)14(21)16(23)18(19)25;/h3-11H,1-2H3;1H/q+1;/p-1/b26-20-;
InChIKey ZEKMVUIYMHPYPK-QUIVHVOCSA-M
Mol Weight 427.81 g/mol
Molecular Formula C20H15ClF5N3
Exact Mass 427.087466 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6EVLEztIqH2
Name N-PENTAFLUOROPHENYL[ALPHA-(4-DIMETHYLAMINOPYRIDINIUM)]BENZIMIDECHLORIDE
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Formula C20H15ClF5N3
InChI InChI=1S/C20H15F5N3.ClH/c1-27(2)13-8-10-28(11-9-13)20(12-6-4-3-5-7-12)26-19-17(24)15(22)14(21)16(23)18(19)25;/h3-11H,1-2H3;1H/q+1;/p-1/b26-20-;
InChIKey ZEKMVUIYMHPYPK-QUIVHVOCSA-M
Instrument Name Varian A56/60A
Literature Reference E.N.KRYUCHKOVA, I.V.KOLESNIKOVA, L.P.DRIZHD, V.A.SAVELOVA, T.D.PETROVA,V.E.PLATONOV (1988) Zhurn.Org.Khim.(Russ. Lang.): v.24, N10, 2042-2046.
NMR Standard C6F6
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD4O methanol-d4