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1-(2,4-dinitrophenyl)-3,5-dimethyl-1H-pyrazole

View entire compound with spectra: 4 NMR

1-(2,4-dinitrophenyl)-3,5-dimethyl-1H-pyrazole
SpectraBase Compound ID 80kXc2h54hx
InChI InChI=1S/2C11H10N4O4/c2*1-7-5-8(2)13(12-7)10-4-3-9(14(16)17)6-11(10)15(18)19/h2*3-6H,1-2H3
InChIKey USBASFRBWFGCFH-UHFFFAOYSA-N
Mol Weight 524.45 g/mol
Molecular Formula C22H20N8O8
Exact Mass 524.14041 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IMm80rEnYRT
Name 3,5-DIMETHYL-1-(2',4'-DINITROPHENYL)-PYRAZOLE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H20N8O8
InChI InChI=1S/2C11H10N4O4/c2*1-7-5-8(2)13(12-7)10-4-3-9(14(16)17)6-11(10)15(18)19/h2*3-6H,1-2H3
InChIKey USBASFRBWFGCFH-UHFFFAOYSA-N
Literature Reference Author M.A.GARCIA,R.M.CLARAMUNT,J.ELGUERO
Literature Reference Citation MAGN.RES.CHEM.,46,697(2008)
Literature Reference DOI 10.1002/mrc.2219
Molecular Weight 524.450 g/mol
Solvent SOLID-STATE
Source File Reference UWLU82543