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N-(ALPHA-TRIFLUOROMETHYL-4-METHYLBENZYLIDENE)-N'-(4-BROMOBENZOYL)-N'-PHENYLUREA
SpectraBase Compound ID HilBcmsIQVl
InChI InChI=1S/C23H16BrF3N2O2/c1-15-7-9-16(10-8-15)20(23(25,26)27)28-22(31)29(19-5-3-2-4-6-19)21(30)17-11-13-18(24)14-12-17/h2-14H,1H3/b28-20-
InChIKey HEVVNQZSXPHYBY-RRAHZORUSA-N
Mol Weight 489.29 g/mol
Molecular Formula C23H16BrF3N2O2
Exact Mass 488.034725 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6SPr0iXur8H
Name N-(ALPHA-TRIFLUOROMETHYL-4-METHYLBENZYLIDENE)-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 C23H16BrF3N2O2
InChI InChI=1S/C23H16BrF3N2O2/c1-15-7-9-16(10-8-15)20(23(25,26)27)28-22(31)29(19-5-3-2-4-6-19)21(30)17-11-13-18(24)14-12-17/h2-14H,1H3/b28-20-
InChIKey HEVVNQZSXPHYBY-RRAHZORUSA-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