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4-CHLORO-2-CYANO-N-(2-PROPANECARBONYL)-BUTANAMIDE
SpectraBase Compound ID 46HXjdEDoTz
InChI InChI=1S/C9H13ClN2O2/c1-6(2)8(13)12-9(14)7(5-11)3-4-10/h6-7H,3-4H2,1-2H3,(H,12,13,14)
InChIKey NNQUFJHTSCVSHU-UHFFFAOYSA-N
Mol Weight 216.67 g/mol
Molecular Formula C9H13ClN2O2
Exact Mass 216.066555 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 70YBvJpuIpe
Name 4-CHLORO-2-CYANO-N-(2-PROPANECARBONYL)-BUTANAMIDE
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H13ClN2O2
InChI InChI=1S/C9H13ClN2O2/c1-6(2)8(13)12-9(14)7(5-11)3-4-10/h6-7H,3-4H2,1-2H3,(H,12,13,14)
InChIKey NNQUFJHTSCVSHU-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 216.667 g/mol
Sample ID 40663
Solvent CDCl3