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3-methyl-4-nitro-1H-pyrazole

View entire compound with spectra: 8 NMR, 2 FTIR, 1 Raman, and 5 MS (GC)

3-methyl-4-nitro-1H-pyrazole
SpectraBase Compound ID 1SED812mfEu
InChI InChI=1S/C4H5N3O2/c1-3-4(7(8)9)2-5-6-3/h2H,1H3,(H,5,6)
InChIKey WTZYTQJELOHMMJ-UHFFFAOYSA-N
Mol Weight 127.1 g/mol
Molecular Formula C4H5N3O2
Exact Mass 127.038176 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LYPiEro0IJ1
Name 3-Methyl-4-nitro-1H-pyrazole
CAS Registry Number 5334-39-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H5N3O2
InChI InChI=1S/C4H5N3O2/c1-3-4(7(8)9)2-5-6-3/h2H,1H3,(H,5,6)
InChIKey WTZYTQJELOHMMJ-UHFFFAOYSA-N
Molecular Weight 127.103 g/mol
SMILES [nH]1nc(c(c1)N(=O)=O)C
SPLASH splash10-03fr-2900000000-7e8dff90315fda62f98b
Source of Spectrum L4-1981-60-0
Synonyms 1H-Pyrazole, 3-methyl-4-nitro- 5-Methyl-4-nitro-1H-pyrazole 3-Methyl-4-nitropyrazole
Wiley ID 1130504