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Urea, N-benzoyl-N'-[4-(4-fluorophenyl)-6-(trifluoromethyl)-2-pyrimidinyl]-
SpectraBase Compound ID 8b26vnzFN64
InChI InChI=1S/C19H12F4N4O2/c20-13-8-6-11(7-9-13)14-10-15(19(21,22)23)25-17(24-14)27-18(29)26-16(28)12-4-2-1-3-5-12/h1-10H,(H2,24,25,26,27,28,29)
InChIKey FUVPZVZUXNBMOA-UHFFFAOYSA-N
Mol Weight 404.32 g/mol
Molecular Formula C19H12F4N4O2
Exact Mass 404.089638 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3K7UhXHU7Q9
Name Urea, N-benzoyl-N'-[4-(4-fluorophenyl)-6-(trifluoromethyl)-2-pyrimidinyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 404.089638292 u
Formula C19H12F4N4O2
InChI InChI=1S/C19H12F4N4O2/c20-13-8-6-11(7-9-13)14-10-15(19(21,22)23)25-17(24-14)27-18(29)26-16(28)12-4-2-1-3-5-12/h1-10H,(H2,24,25,26,27,28,29)
InChIKey FUVPZVZUXNBMOA-UHFFFAOYSA-N
Molecular Weight 404.325 g/mol
SMILES C=1(C=CC=CC1)C(NC(NC1=NC(C2=CC=C(C=C2)F)=CC(=N1)C(F)(F)F)=O)=O