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4-BROMO-N-(3-TRIFLUOROMETHYL-3-HYDROXY-5-OXO-1-PHENYL-4-PYRAZOLIDINYL)-N-METHYL-BENZAMIDE
SpectraBase Compound ID 5OdIzK7T2C0
InChI InChI=1S/C18H15BrF3N3O3/c1-24(15(26)11-7-9-12(19)10-8-11)14-16(27)25(13-5-3-2-4-6-13)23-17(14,28)18(20,21)22/h2-10,14,23,28H,1H3
InChIKey OEOZMYHPPZACLR-UHFFFAOYSA-N
Mol Weight 458.24 g/mol
Molecular Formula C18H15BrF3N3O3
Exact Mass 457.024889 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HERMvL7gsSo
Name 4-BROMO-N-(3-TRIFLUOROMETHYL-3-HYDROXY-5-OXO-1-PHENYL-4-PYRAZOLIDINYL)-N-METHYL-BENZAMIDE
Compound Number 5C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H15BrF3N3O3
InChI InChI=1S/C18H15BrF3N3O3/c1-24(15(26)11-7-9-12(19)10-8-11)14-16(27)25(13-5-3-2-4-6-13)23-17(14,28)18(20,21)22/h2-10,14,23,28H,1H3
InChIKey OEOZMYHPPZACLR-UHFFFAOYSA-N
Literature Reference Author M.KAWASE,H.KOIWAI
Literature Reference Citation CHEM.PHARM.BULL.,56,433(2008)
Literature Reference DOI 10.1248/cpb.56.433
Molecular Weight 458.235 g/mol
Sample ID 1469
Solvent CDCl3