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1-METHYLCARBONYL-3-(2-NITRO-5-METHOXYPHENYL)-4,5-DIHYDRO-1H-PYRAZOLE
SpectraBase Compound ID CBamLH613mF
InChI InChI=1S/C12H13N3O4/c1-8(16)14-6-5-11(13-14)10-7-9(19-2)3-4-12(10)15(17)18/h3-4,7H,5-6H2,1-2H3
InChIKey YBFAPIZZIRTUKB-UHFFFAOYSA-N
Mol Weight 263.25 g/mol
Molecular Formula C12H13N3O4
Exact Mass 263.090606 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Yq8WxgYuKe
Name 1-METHYLCARBONYL-3-(2-NITRO-5-METHOXYPHENYL)-4,5-DIHYDRO-1H-PYRAZOLE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13N3O4
InChI InChI=1S/C12H13N3O4/c1-8(16)14-6-5-11(13-14)10-7-9(19-2)3-4-12(10)15(17)18/h3-4,7H,5-6H2,1-2H3
InChIKey YBFAPIZZIRTUKB-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 263.253 g/mol
Solvent CDCl3
Source File Reference UWBT15967