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N-(3,3,3-TRIFLUORO-2-OXO-1-PHENYLPROPYL)-BENZAMIDE
SpectraBase Compound ID GVspAM7hcM
InChI InChI=1S/C16H12F3NO2/c17-16(18,19)14(21)13(11-7-3-1-4-8-11)20-15(22)12-9-5-2-6-10-12/h1-10,13H,(H,20,22)
InChIKey FJSJECJJQLAEIS-UHFFFAOYSA-N
Mol Weight 307.27 g/mol
Molecular Formula C16H12F3NO2
Exact Mass 307.082013 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7PphxS0WyPf
Name N-(3,3,3-TRIFLUORO-2-OXO-1-PHENYLPROPYL)-BENZAMIDE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H12F3NO2
InChI InChI=1S/C16H12F3NO2/c17-16(18,19)14(21)13(11-7-3-1-4-8-11)20-15(22)12-9-5-2-6-10-12/h1-10,13H,(H,20,22)
InChIKey FJSJECJJQLAEIS-UHFFFAOYSA-N
Literature Reference Author C.W.DERSTINE,D.N.SMITH,J.A.KATZENELLENBOGEN
Literature Reference Citation J.AM.CHEM.SOC.,118,8485(1996)
Literature Reference DOI 10.1021/ja9614833
Molecular Weight 307.272 g/mol
Sample ID 36269
Solvent DMSO-D6:D2O