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3,4-DIMETHYL-1-(2',4',6'-TRINITROPHENYL)-PYRAZOLE

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3,4-DIMETHYL-1-(2',4',6'-TRINITROPHENYL)-PYRAZOLE
SpectraBase Compound ID mZ5iMhb9Vh
InChI InChI=1S/C11H9N5O6/c1-6-5-13(12-7(6)2)11-9(15(19)20)3-8(14(17)18)4-10(11)16(21)22/h3-5H,1-2H3
InChIKey YAYYKXKJZLPAKM-UHFFFAOYSA-N
Mol Weight 307.22 g/mol
Molecular Formula C11H9N5O6
Exact Mass 307.055283 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B9yALhkDbFa
Name 3,4-DIMETHYL-1-(2',4',6'-TRINITROPHENYL)-PYRAZOLE
Compound Number 17
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H9N5O6
InChI InChI=1S/C11H9N5O6/c1-6-5-13(12-7(6)2)11-9(15(19)20)3-8(14(17)18)4-10(11)16(21)22/h3-5H,1-2H3
InChIKey YAYYKXKJZLPAKM-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
Solvent SOLID-STATE
Source File Reference UWLU82554