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1H-Pyrazole-5-carboxylic acid, 3,4-dicyano-1-methyl-, methyl ester
SpectraBase Compound ID 3Msn39Y4ewb
InChI InChI=1S/C8H6N4O2/c1-12-7(8(13)14-2)5(3-9)6(4-10)11-12/h1-2H3
InChIKey XNMCAOZPGSOOKG-UHFFFAOYSA-N
Mol Weight 190.16 g/mol
Molecular Formula C8H6N4O2
Exact Mass 190.049075 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LooMMlJXYvd
Name 1H-Pyrazole-5-carboxylic acid, 3,4-dicyano-1-methyl-, methyl ester
Alternate Name(s) Methyl 3,4-dicyano-1-methyl-1H-pyrazole-5-carboxylate Methyl ester of 3,4-dicyan-1-methyl-5-pyrazolcarboxylic acid 4,5-Dicyano-2-methyl-3-pyrazolecarboxylic acid methyl ester Methyl 4,5-dicyano-2-methylpyrazole-3-carboxylate Methyl 4,5-dicyano-2-methyl-pyrazole-3-carboxylate
CAS Registry Number 70910-26-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6N4O2
InChI InChI=1S/C8H6N4O2/c1-12-7(8(13)14-2)5(3-9)6(4-10)11-12/h1-2H3
InChIKey XNMCAOZPGSOOKG-UHFFFAOYSA-N
Molecular Weight 190.162 g/mol
SMILES c1(c(c(C#N)n[n]1C)C#N)C(=O)OC
SPLASH splash10-000i-0900000000-457e5bd72bde541b6886
Source of Spectrum K-112-1730-0
Wiley ID 1186125