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N-(ALPHA-TRIFLUOROMETHYLBENZYLIDENE)-N'-(4-BROMOBENZOYL)-N'-PHENYLUREA
SpectraBase Compound ID D037dHkUlLy
InChI InChI=1S/C22H14BrF3N2O2/c23-17-13-11-16(12-14-17)20(29)28(18-9-5-2-6-10-18)21(30)27-19(22(24,25)26)15-7-3-1-4-8-15/h1-14H/b27-19-
InChIKey TYJYUEGICUOKFS-DIBXZPPDSA-N
Mol Weight 475.27 g/mol
Molecular Formula C22H14BrF3N2O2
Exact Mass 474.019075 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DELgwTilHNK
Name N-(ALPHA-TRIFLUOROMETHYLBENZYLIDENE)-N'-(4-BROMOBENZOYL)-N'-PHENYLUREA
Comments SCALE INVERTED;WP-200 (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H14BrF3N2O2
InChI InChI=1S/C22H14BrF3N2O2/c23-17-13-11-16(12-14-17)20(29)28(18-9-5-2-6-10-18)21(30)27-19(22(24,25)26)15-7-3-1-4-8-15/h1-14H/b27-19-
InChIKey TYJYUEGICUOKFS-DIBXZPPDSA-N
Instrument Name SEE COMMENT
Literature Reference M.V.VOVK, V.I.DOROKHOV, L.I.SAMARAI (1988) Zhurn.Org.Khim.(Russ. Lang.): v.24,N4, 727-732.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d