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methyl 4-cyano-2H-pyrazole-3-carboxylate
SpectraBase Compound ID Et85YDbrDne
InChI InChI=1S/C6H5N3O2/c1-11-6(10)5-4(2-7)3-8-9-5/h3H,1H3,(H,8,9)
InChIKey FZMAIXSFOQAPCI-UHFFFAOYSA-N
Mol Weight 151.12 g/mol
Molecular Formula C6H5N3O2
Exact Mass 151.038176 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BGxcl6yKavH
Name 4-cyano-1H-pyrazole-5-carboxylic acid methyl ester
CAS Registry Number 105020-45-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H5N3O2
InChI InChI=1S/C6H5N3O2/c1-11-6(10)5-4(2-7)3-8-9-5/h3H,1H3,(H,8,9)
InChIKey FZMAIXSFOQAPCI-UHFFFAOYSA-N
Molecular Weight 151.125 g/mol
SMILES [nH]1c(c(cn1)C#N)C(=O)OC
SPLASH splash10-00di-3900000000-07f9ab6fa8b838c92490
Source of Spectrum K-120-168-26
Synonyms Methyl 4-cyano-1H-pyrazole-5-carboxylate
Wiley ID 1147977