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3,5-dimethyl-1-(2,4,6-trinitrophenyl)pyrazole
SpectraBase Compound ID 83k6lQRBRj9
InChI InChI=1S/C11H9N5O6/c1-6-3-7(2)13(12-6)11-9(15(19)20)4-8(14(17)18)5-10(11)16(21)22/h3-5H,1-2H3
InChIKey YNBFJUGFNNAYJU-UHFFFAOYSA-N
Mol Weight 307.22 g/mol
Molecular Formula C11H9N5O6
Exact Mass 307.055283 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dtjm69lflfY
Name 3,5-dimethyl-1-(2,4,6-trinitrophenyl)pyrazole
Compound Number 911
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H9N5O6
InChI InChI=1S/C11H9N5O6/c1-6-3-7(2)13(12-6)11-9(15(19)20)4-8(14(17)18)5-10(11)16(21)22/h3-5H,1-2H3
InChIKey YNBFJUGFNNAYJU-UHFFFAOYSA-N
Literature Reference Author M.BEGTRUP,G.BOYER,P.CABILDO,C.CATIVIELA,R.M.CLARAMUNT,J.ELGU ERO,J.I.GARCIA,C.TOI
Literature Reference Citation MAGN.RES.CHEM.,31,107(1993)
Literature Reference DOI 10.1002/mrc.1260310202
Molecular Weight 307.222 g/mol
Solvent DMSO-D6
Source File Reference UWVP1040