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3,5-Dimethyl-1-(4-nitrophenyl)-1H-pyrazole

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3,5-Dimethyl-1-(4-nitrophenyl)-1H-pyrazole
SpectraBase Compound ID 97UMPCogkwk
InChI InChI=1S/2C11H11N3O2/c2*1-8-7-9(2)13(12-8)10-3-5-11(6-4-10)14(15)16/h2*3-7H,1-2H3
InChIKey QUVHBWHHIDVANW-UHFFFAOYSA-N
Mol Weight 434.46 g/mol
Molecular Formula C22H22N6O4
Exact Mass 434.170253 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HFZGvVGteLW
Name 3,5-DIMETHYL-1-(4-NITROPHENYL)-1H-PYRAZOLE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22N6O4
InChI InChI=1S/2C11H11N3O2/c2*1-8-7-9(2)13(12-8)10-3-5-11(6-4-10)14(15)16/h2*3-7H,1-2H3
InChIKey QUVHBWHHIDVANW-UHFFFAOYSA-N
Literature Reference Author R.M.CLARAMUNT,M.D.S.MARIA,D.SANZ,I.ALKORTA,J.ELGUERO
Literature Reference Citation MAGN.RES.CHEM.,44,566(2006)
Literature Reference DOI 10.1002/mrc.1775
Solvent SOLID-STATE
Source File Reference UWSI43694