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1-ETHYL-N,3-DIMETHYL-4-NITRO-N-(1,3-DIMETHYL-1H-PYRAZOL-5-YL)-1H-PYRAZOL-5-CARBOXAMIDE;MAJOR-ISOMER

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1-ETHYL-N,3-DIMETHYL-4-NITRO-N-(1,3-DIMETHYL-1H-PYRAZOL-5-YL)-1H-PYRAZOL-5-CARBOXAMIDE;MAJOR-ISOMER
SpectraBase Compound ID BwnpVViQb4L
InChI InChI=1S/C13H18N6O3/c1-6-18-12(11(19(21)22)9(3)15-18)13(20)16(4)10-7-8(2)14-17(10)5/h7H,6H2,1-5H3
InChIKey AAQMTUKGCJYKDU-UHFFFAOYSA-N
Mol Weight 306.33 g/mol
Molecular Formula C13H18N6O3
Exact Mass 306.144038 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Pdg6jJgL5E
Name 1-ETHYL-N,3-DIMETHYL-4-NITRO-N-(1,3-DIMETHYL-1H-PYRAZOL-5-YL)-1H-PYRAZOL-5-CARBOXAMIDE;MINOR-ISOMER
Compound Number 4D
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C13H18N6O3/c1-6-18-12(11(19(21)22)9(3)15-18)13(20)16(4)10-7-8(2)14-17(10)5/h7H,6H2,1-5H3
InChIKey AAQMTUKGCJYKDU-UHFFFAOYSA-N
Literature Reference O.MIGLIARA,L.LAMARTINA,M.TIMONERI,S.PLESCIA J.HETCYCL.CHEM.,32,835(1995)
Solvent Dimethyl sulfoxide-d6
Technique APT, DEPT, INEPT; C/H SHIFT CORRELATION