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1-(4-FLUOROBENZOYL)-2-OXO-3-PYRROLIDINE-CARBONITRILE
SpectraBase Compound ID 5gqRDRbCwz5
InChI InChI=1S/C12H9FN2O2/c13-10-3-1-8(2-4-10)11(16)15-6-5-9(7-14)12(15)17/h1-4,9H,5-6H2
InChIKey XZOZLKCJHHJEBL-UHFFFAOYSA-N
Mol Weight 232.21 g/mol
Molecular Formula C12H9FN2O2
Exact Mass 232.064806 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EkgnDaDP9qK
Name 1-(4-FLUOROBENZOYL)-2-OXO-3-PYRROLIDINE-CARBONITRILE
Compound Number 2H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H9FN2O2
InChI InChI=1S/C12H9FN2O2/c13-10-3-1-8(2-4-10)11(16)15-6-5-9(7-14)12(15)17/h1-4,9H,5-6H2
InChIKey XZOZLKCJHHJEBL-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 232.214 g/mol
Sample ID 40659
Solvent CDCl3