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1H-Pyrazole-3-carboxylic acid, 5-amino-4-cyano-1-(4-methoxyphenyl)-
SpectraBase Compound ID IZDL1rNtA5Z
InChI InChI=1S/C12H10N4O3/c1-19-8-4-2-7(3-5-8)16-11(14)9(6-13)10(15-16)12(17)18/h2-5H,14H2,1H3,(H,17,18)
InChIKey RWRMAVMZGOUYKV-UHFFFAOYSA-N
Mol Weight 258.24 g/mol
Molecular Formula C12H10N4O3
Exact Mass 258.07529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8NH4yk8CgOy
Name 1H-Pyrazole-3-carboxylic acid, 5-amino-4-cyano-1-(4-methoxyphenyl)-
Alternate Name(s) 5-Amino-4-cyano-1-(4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10N4O3
InChI InChI=1S/C12H10N4O3/c1-19-8-4-2-7(3-5-8)16-11(14)9(6-13)10(15-16)12(17)18/h2-5H,14H2,1H3,(H,17,18)
InChIKey RWRMAVMZGOUYKV-UHFFFAOYSA-N
Molecular Weight 258.237 g/mol
SMILES Nc1c(c(C(=O)O)n[n]1-c1ccc(cc1)OC)C#N
SPLASH splash10-0nor-9410000000-f89884d7b066a97a469a
Source of Spectrum IY-2-5118-5
Wiley ID 1659168