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1-CYCLOPROPYLCARBONYL-3-(2-NITRO-5-CHLOROPHENYL)-4,5-DIHYDRO-1H-PYRAZOLE
SpectraBase Compound ID JapAU9sfttB
InChI InChI=1S/C13H12ClN3O3/c14-9-3-4-12(17(19)20)10(7-9)11-5-6-16(15-11)13(18)8-1-2-8/h3-4,7-8H,1-2,5-6H2
InChIKey NCQAHFPOALWEES-UHFFFAOYSA-N
Mol Weight 293.71 g/mol
Molecular Formula C13H12ClN3O3
Exact Mass 293.056719 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BKvAABIIu4q
Name 1-CYCLOPROPYLCARBONYL-3-(2-NITRO-5-CHLOROPHENYL)-4,5-DIHYDRO-1H-PYRAZOLE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H12ClN3O3
InChI InChI=1S/C13H12ClN3O3/c14-9-3-4-12(17(19)20)10(7-9)11-5-6-16(15-11)13(18)8-1-2-8/h3-4,7-8H,1-2,5-6H2
InChIKey NCQAHFPOALWEES-UHFFFAOYSA-N
Literature Reference Author M.D.CARRION,M.CHAYAH,D.CHOQUESILLO-LAZARTE,M.A.GALLO,A.ESPIN OSA,A.ENTRENA
Literature Reference Citation MAGN.RES.CHEM.,50,58(2012)
Literature Reference DOI 10.1002/mrc.2843
Molecular Weight 293.710 g/mol
Solvent CDCl3
Source File Reference UWBT15984