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2-ANILINO-3,5,6-TRIFLUOROBENZOIC ACID
SpectraBase Compound ID ErqFVmNJrrZ
InChI InChI=1S/C13H8F3NO2/c14-8-6-9(15)12(10(11(8)16)13(18)19)17-7-4-2-1-3-5-7/h1-6,17H,(H,18,19)
InChIKey OCGRHHWCYNCNNK-UHFFFAOYSA-N
Mol Weight 267.21 g/mol
Molecular Formula C13H8F3NO2
Exact Mass 267.050713 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DLluEiWw33Y
Name 2-ANILINO-3,5,6-TRIFLUOROBENZOIC 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 C13H8F3NO2
InChI InChI=1S/C13H8F3NO2/c14-8-6-9(15)12(10(11(8)16)13(18)19)17-7-4-2-1-3-5-7/h1-6,17H,(H,18,19)
InChIKey OCGRHHWCYNCNNK-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