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4-CHLORO-3,5-DIMETHOXY-1-BENZYLPYRAZOLE

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4-CHLORO-3,5-DIMETHOXY-1-BENZYLPYRAZOLE
SpectraBase Compound ID BVqsiFIoMXQ
InChI InChI=1S/C12H13ClN2O2/c1-16-11-10(13)12(17-2)15(14-11)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
InChIKey XEMKXWKZPXVZIF-UHFFFAOYSA-N
Mol Weight 252.7 g/mol
Molecular Formula C12H13ClN2O2
Exact Mass 252.066555 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DMC9PbjNwKp
Name 1-BENZYL-4-CHLORO-3,5-DIMETHOXY-1H-PYRAZOLE
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13ClN2O2
InChI InChI=1S/C12H13ClN2O2/c1-16-11-10(13)12(17-2)15(14-11)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
InChIKey XEMKXWKZPXVZIF-UHFFFAOYSA-N
Literature Reference Author W.HOLZER,H.GRUBER
Literature Reference Citation J.HETCYCL.CHEM.,32,1351(1995)
Literature Reference DOI 10.1002/jhet.5570320441
Molecular Weight 252.700 g/mol
Solvent CDCl3
Source File Reference UWMZ3014