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4-CHLORO-2-CYANO-N-(4-FLUOROBENZOYL)-BUTANAMIDE
SpectraBase Compound ID KJ3BXtOTd2W
InChI InChI=1S/C12H10ClFN2O2/c13-6-5-9(7-15)12(18)16-11(17)8-1-3-10(14)4-2-8/h1-4,9H,5-6H2,(H,16,17,18)
InChIKey BJBMBWOGAOZGKW-UHFFFAOYSA-N
Mol Weight 268.68 g/mol
Molecular Formula C12H10ClFN2O2
Exact Mass 268.041483 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4u4I3VHw19l
Name 4-CHLORO-2-CYANO-N-(4-FLUOROBENZOYL)-BUTANAMIDE
Compound Number 3H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H10ClFN2O2
InChI InChI=1S/C12H10ClFN2O2/c13-6-5-9(7-15)12(18)16-11(17)8-1-3-10(14)4-2-8/h1-4,9H,5-6H2,(H,16,17,18)
InChIKey BJBMBWOGAOZGKW-UHFFFAOYSA-N
Literature Reference Author K.YAMAGATA,F.OKABE,H.MARUOKA,Y.TAGAWA
Literature Reference Citation J.HETCYCL.CHEM.,42,543(2005)
Literature Reference DOI 10.1002/jhet.5570420411
Molecular Weight 268.675 g/mol
Sample ID 40668
Solvent CDCl3