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N-PENTAFLUOROPHENYL[ALPHA-(4'-DIMETHYLAMINOPYRIDINIUM)]-4-METHYLBENZIMIDE CHLORIDE
SpectraBase Compound ID ogAeX6SBrK
InChI InChI=1S/C21H17F5N3.ClH/c1-12-4-6-13(7-5-12)21(29-10-8-14(9-11-29)28(2)3)27-20-18(25)16(23)15(22)17(24)19(20)26;/h4-11H,1-3H3;1H/q+1;/p-1/b27-21-;
InChIKey RIOVGSVLUJKTPL-DJILMAANSA-M
Mol Weight 441.83 g/mol
Molecular Formula C21H17ClF5N3
Exact Mass 441.103116 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C4QQrr5cHQn
Name N-PENTAFLUOROPHENYL[ALPHA-(4'-DIMETHYLAMINOPYRIDINIUM)]-4-METHYLBENZIMIDE CHLORIDE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H17ClF5N3
InChI InChI=1S/C21H17F5N3.ClH/c1-12-4-6-13(7-5-12)21(29-10-8-14(9-11-29)28(2)3)27-20-18(25)16(23)15(22)17(24)19(20)26;/h4-11H,1-3H3;1H/q+1;/p-1/b27-21-;
InChIKey RIOVGSVLUJKTPL-DJILMAANSA-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