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1H-Pyrazole-3-carboxylic acid, 5-amino-4-cyano-1-(1,1-dimethylethyl)-
SpectraBase Compound ID DIVSe4w1WXn
InChI InChI=1S/C9H12N4O2/c1-9(2,3)13-7(11)5(4-10)6(12-13)8(14)15/h11H2,1-3H3,(H,14,15)
InChIKey SNYQDMCQSPYNAH-UHFFFAOYSA-N
Mol Weight 208.22 g/mol
Molecular Formula C9H12N4O2
Exact Mass 208.096026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0SvC96Ek88
Name 1H-Pyrazole-3-carboxylic acid, 5-amino-4-cyano-1-(1,1-dimethylethyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12N4O2
InChI InChI=1S/C9H12N4O2/c1-9(2,3)13-7(11)5(4-10)6(12-13)8(14)15/h11H2,1-3H3,(H,14,15)
InChIKey SNYQDMCQSPYNAH-UHFFFAOYSA-N
Molecular Weight 208.221 g/mol
SMILES Nc1c(c(C(=O)O)n[n]1C(C)(C)C)C#N
SPLASH splash10-052f-9100000000-848bb7afa5ddef961621
Source of Spectrum IY-2-4935-0
Synonyms 5-Amino-1-tert-butyl-4-cyano-3-pyrazolecarboxylic acid 5-Amino-1-tert-butyl-4-cyanopyrazole-3-carboxylic acid 5-Azanyl-1-tert-butyl-4-cyano-pyrazole-3-carboxylic acid
Wiley ID 1657333