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2-(2,2,2-TRIFLUORO-1-PHENYLETHYLIDENAMINOCARBONYLOXY)BENZOIC ACID
SpectraBase Compound ID KXw1cg4mRP7
InChI InChI=1S/C16H10F3NO4/c17-16(18,19)13(10-6-2-1-3-7-10)20-15(23)24-12-9-5-4-8-11(12)14(21)22/h1-9H,(H,21,22)/b20-13+
InChIKey LHHMKDJSGGEDGB-DEDYPNTBSA-N
Mol Weight 337.25 g/mol
Molecular Formula C16H10F3NO4
Exact Mass 337.056192 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L55btR1oGwZ
Name 2-(2,2,2-TRIFLUORO-1-PHENYLETHYLIDENAMINOCARBONYLOXY)BENZOIC ACID
Comments SCALE INVERTED. MIXTURE WITH ISOCYANATE;WP-200 (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H10F3NO4
InChI InChI=1S/C16H10F3NO4/c17-16(18,19)13(10-6-2-1-3-7-10)20-15(23)24-12-9-5-4-8-11(12)14(21)22/h1-9H,(H,21,22)/b20-13+
InChIKey LHHMKDJSGGEDGB-DEDYPNTBSA-N
Instrument Name SEE COMMENT
Literature Reference M.V.VOVK, V.I.DOROKHOV, E.A.ROMANENKO, L.I.SAMARAI (1992)Ukrain.Khim.Zhurn.(Russ. Lang.): v.58, N4, 327-333.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6