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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7QO9Oznxhp7
Name 1H-Pyrazole-5-carboxylic acid, 3-nitro-, methyl ester
Alternate Name(s) 3-Nitro-1H-pyrazole-5-carboxylic acid methyl ester Methyl 3-nitro-1H-pyrazole-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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
SMILES [nH]1c(cc(n1)N(=O)=O)C(=O)OC
SPLASH splash10-00ku-9200000000-55a2109b09b749861de7
Wiley ID 1449761