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1,3-dimethyl-4-nitropyrazole-5-methanol, p-chlorocarbanilate (ester)

View entire compound with spectra: 3 NMR, and 1 FTIR

1,3-dimethyl-4-nitropyrazole-5-methanol, p-chlorocarbanilate (ester)
SpectraBase Compound ID 4KF4WQN0R6o
InChI InChI=1S/C13H13ClN4O4/c1-8-12(18(20)21)11(17(2)16-8)7-22-13(19)15-10-5-3-9(14)4-6-10/h3-6H,7H2,1-2H3,(H,15,19)
InChIKey RLMBQKNQUOHVQP-UHFFFAOYSA-N
Mol Weight 324.72 g/mol
Molecular Formula C13H13ClN4O4
Exact Mass 324.062533 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4tsMMP4dpsm
Name 1,3-DIMETHYL-4-NITROPYRAZOLE-5-METHANOL, p-CHLOROCARBANILATE(ESTER)
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13ClN4O4
InChI InChI=1S/C13H13ClN4O4/c1-8-12(18(20)21)11(17(2)16-8)7-22-13(19)15-10-5-3-9(14)4-6-10/h3-6H,7H2,1-2H3,(H,15,19)
InChIKey RLMBQKNQUOHVQP-UHFFFAOYSA-N
Melting Point 176-178C
Molecular Weight 324.73
Solvent Polysol; Reference=TMS Spectrometer= Bruker AC-300
Synonyms PYRAZOLE-5-METHANOL, 1,3-DIMETHYL- 4-NITRO-, P-CHLOROCARBANILATE (ESTER)