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2-(N-PHENYL-N-BENZYLAMINO)-3,4,5,6-TETRAFLUOROBENZOIC ACID
SpectraBase Compound ID ITS8hH3Y6xp
InChI InChI=1S/C20H13F4NO2/c21-15-14(20(26)27)19(18(24)17(23)16(15)22)25(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10H,11H2,(H,26,27)
InChIKey CNTFYXLFFGCZOY-UHFFFAOYSA-N
Mol Weight 375.32 g/mol
Molecular Formula C20H13F4NO2
Exact Mass 375.088241 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HtH1rZ5d9Bu
Name 2-(N-PHENYL-N-BENZYLAMINO)-3,4,5,6-TETRAFLUOROBENZOIC ACID
Comments INTERNAL STANDARD-C6F6 (163.9 FROM CFCL3). SCALE INVERTED.
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H13F4NO2
InChI InChI=1S/C20H13F4NO2/c21-15-14(20(26)27)19(18(24)17(23)16(15)22)25(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10H,11H2,(H,26,27)
InChIKey CNTFYXLFFGCZOY-UHFFFAOYSA-N
Instrument Name Varian A56/60A
Literature Reference T.N.GERASIMOVA, N.V.SEMIKOLENOVA, N.A.ORLOVA, T.V.FOMENKO, E.P.FOKIN (1975)Izv.Sibir.Otdel.Akad.Nauk Ser.Khim.(Russ. Lang.): N6, 54-60.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C4H8O tetrahydrofura