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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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HR2LG7C63Zn
Name 1-methylpyrazole-3,5-dicarboxylic acid
Compound Number 352
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. 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
Literature Reference Author M.BEGTRUP,G.BOYER,P.CABILDO,C.CATIVIELA,R.M.CLARAMUNT,J.ELGU ERO,J.I.GARCIA,C.TOI
Literature Reference Citation MAGN.RES.CHEM.,31,107(1993)
Literature Reference DOI 10.1002/mrc.1260310202
Molecular Weight 170.125 g/mol
Solvent DMSO-D6
Source File Reference UWVP1519