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1-methylpyrazole-3-carboxylic acid
SpectraBase Compound ID wsni72TfE4
InChI InChI=1S/C5H6N2O2/c1-7-3-4(2-6-7)5(8)9/h2-3H,1H3,(H,8,9)
InChIKey UPPPWUOZCSMDTR-UHFFFAOYSA-N
Mol Weight 126.11 g/mol
Molecular Formula C5H6N2O2
Exact Mass 126.042927 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9QAl4n4rJBK
Name 1-Methylpyrazole-4-carboxylic acid
Alternate Name(s) 1-Methyl-1H-pyrazole-4-carboxylic acid 1H-Pyrazole-4-carboxylic acid, 1-methyl- 1-Methyl-4-pyrazolecarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H6N2O2
InChI InChI=1S/C5H6N2O2/c1-7-3-4(2-6-7)5(8)9/h2-3H,1H3,(H,8,9)
InChIKey UPPPWUOZCSMDTR-UHFFFAOYSA-N
Molecular Weight 126.115 g/mol
SMILES OC(c1c[n](C)nc1)=O
SPLASH splash10-0a4i-5900000000-e7eefe5af882b156b741
Source of Spectrum AC-1990-663-5
Wiley ID 747758