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methyl 4-cyano-2H-pyrazole-3-carboxylate
SpectraBase Compound ID Et85YDbrDne
InChI InChI=1S/C6H5N3O2/c1-11-6(10)5-4(2-7)3-8-9-5/h3H,1H3,(H,8,9)
InChIKey FZMAIXSFOQAPCI-UHFFFAOYSA-N
Mol Weight 151.12 g/mol
Molecular Formula C6H5N3O2
Exact Mass 151.038176 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LRBQ5p8qeDi
Name methyl 4-cyano-2H-pyrazole-3-carboxylate
Compound Number 60
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H5N3O2
InChI InChI=1S/C6H5N3O2/c1-11-6(10)5-4(2-7)3-8-9-5/h3H,1H3,(H,8,9)
InChIKey FZMAIXSFOQAPCI-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 151.125 g/mol
Solvent DMSO-D6
Source File Reference UWVP1809