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1-(4-CHLOROBENZOYL)-2-OXO-3-PYRROLIDINE-CARBONITRILE
SpectraBase Compound ID D9WTxBYFXTN
InChI InChI=1S/C12H9ClN2O2/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 BCMQDQHURKAFOG-UHFFFAOYSA-N
Mol Weight 248.67 g/mol
Molecular Formula C12H9ClN2O2
Exact Mass 248.035255 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EROf0DXFqWG
Name 1-(4-CHLOROBENZOYL)-2-OXO-3-PYRROLIDINE-CARBONITRILE
Compound Number 2I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H9ClN2O2
InChI InChI=1S/C12H9ClN2O2/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 BCMQDQHURKAFOG-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 248.669 g/mol
Sample ID 40660
Solvent CDCl3