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1-methylpyrazole-3,5-dicarboxylic acid
SpectraBase Compound ID Ln1XoaKrcG6
InChI InChI=1S/C6H6N2O4/c1-8-4(6(11)12)2-3(7-8)5(9)10/h2H,1H3,(H,9,10)(H,11,12)
InChIKey MFKWUVYTAQKQMF-UHFFFAOYSA-N
Mol Weight 170.12 g/mol
Molecular Formula C6H6N2O4
Exact Mass 170.032757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IVbpvcFmPRy
Name 1-Methyl-1H-pyrazole-3,5-dicarboxylic acid
Alternate Name(s) 1-Methylpyrazole-3,5-dicarboxylic acid 1H-Pyrazole-3,5-dicarboxylic acid, 1-methyl-
CAS Registry Number 75092-39-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H6N2O4
InChI InChI=1S/C6H6N2O4/c1-8-4(6(11)12)2-3(7-8)5(9)10/h2H,1H3,(H,9,10)(H,11,12)
InChIKey MFKWUVYTAQKQMF-UHFFFAOYSA-N
Molecular Weight 170.124 g/mol
SMILES OC(c1cc(C(=O)O)[n](n1)C)=O
SPLASH splash10-0ul0-9600000000-61dd5a7872ed861cdcda
Source of Spectrum AD-0-2532-0
Wiley ID 1433918