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1-phenylpyrazole-3,4-dicarboxylic acid, dimethyl ester

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1-phenylpyrazole-3,4-dicarboxylic acid, dimethyl ester
SpectraBase Compound ID B84Di3CslyZ
InChI InChI=1S/C13H12N2O4/c1-18-12(16)10-8-15(9-6-4-3-5-7-9)14-11(10)13(17)19-2/h3-8H,1-2H3
InChIKey VABYYEHSSHPDRI-UHFFFAOYSA-N
Mol Weight 260.25 g/mol
Molecular Formula C13H12N2O4
Exact Mass 260.079707 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DvTSCr9yZZp
Name Dimethyl 1-phenyl-pyrazole-3,4-dicarboxylate
CAS Registry Number 3198-98-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H12N2O4
InChI InChI=1S/C13H12N2O4/c1-18-12(16)10-8-15(9-6-4-3-5-7-9)14-11(10)13(17)19-2/h3-8H,1-2H3
InChIKey VABYYEHSSHPDRI-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference P. Sohar, O. Feher, E. Tihanyi, Org. Magn. Resonance 12, 205 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3