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

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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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3HsxpVpL8bW
Name 3-Methyl-4-nitro-pyrazole
CAS Registry Number 5334-39-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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
Instrument Name Bruker WP-80
Literature Reference P. Cabildo, R.M. Claramunt, J. Elguero, Org. Magn. Resonance 22, 603 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6