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1H-Pyrazole-5-carboxylic acid, 3-nitro-, methyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1H-Pyrazole-5-carboxylic acid, 3-nitro-, methyl ester
SpectraBase Compound ID 2A8WXO6rzDJ
InChI InChI=1S/C5H5N3O4/c1-12-5(9)3-2-4(7-6-3)8(10)11/h2H,1H3,(H,6,7)
InChIKey OTINMTPELZSAPX-UHFFFAOYSA-N
Mol Weight 171.11 g/mol
Molecular Formula C5H5N3O4
Exact Mass 171.028006 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DMBoc8NLK5N
Name methyl 5-nitro-1H-pyrazole-3-carboxylate
Copyright Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 171.028005649 u
Formula C5H5N3O4
InChI InChI=1S/C5H5N3O4/c1-12-5(9)3-2-4(7-6-3)8(10)11/h2H,1H3,(H,6,7)
InChIKey OTINMTPELZSAPX-UHFFFAOYSA-N
Molecular Weight 171.112 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_9113
Solvent DMSO-d6
Source Vendor ID: NMR/13228338