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N-(ALPHA-TRIFLUOROMETHYLBENZYLIDENE)-N'-(4-BROMOBENZOYL)-N'-(2,4,6-TRIMETHYLPHENYL)UREA
SpectraBase Compound ID 9aHSuARwkhj
InChI InChI=1S/C25H20BrF3N2O2/c1-15-13-16(2)21(17(3)14-15)31(23(32)19-9-11-20(26)12-10-19)24(33)30-22(25(27,28)29)18-7-5-4-6-8-18/h4-14H,1-3H3/b30-22-
InChIKey ULFNPDUSBKUPTP-SWKFRHMKSA-N
Mol Weight 517.35 g/mol
Molecular Formula C25H20BrF3N2O2
Exact Mass 516.066025 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6NiV0kJmBjv
Name N-(ALPHA-TRIFLUOROMETHYLBENZYLIDENE)-N'-(2,4,6-TRIMETHYLPHENYL)-N'-(4-BROMOBENZOYL)UREA
Comments SCALE INVERTED;WP-200 (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C25H20BrF3N2O2
InChI InChI=1S/C25H20BrF3N2O2/c1-15-13-16(2)21(17(3)14-15)31(23(32)19-9-11-20(26)12-10-19)24(33)30-22(25(27,28)29)18-7-5-4-6-8-18/h4-14H,1-3H3/b30-22-
InChIKey ULFNPDUSBKUPTP-SWKFRHMKSA-N
Instrument Name SEE COMMENT
Literature Reference M.V.VOVK, V.I.DOROKHOV, V.V.PIROZHENKO, L.I.SAMARAI (1989)Zhurn.Org.Khim.(Russ. Lang.): v.25, N8, 1634-1637.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6