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4-(trans-2-Carboxamido-2-cyano-ethenyl)-3-methyl-1-phenyl-pyrazolol-5 anion

View entire compound with spectra: 1 NMR

4-(trans-2-Carboxamido-2-cyano-ethenyl)-3-methyl-1-phenyl-pyrazolol-5 anion
SpectraBase Compound ID LJMqOZjcybA
InChI InChI=1S/C14H12N4O2/c1-9-12(7-10(8-15)13(16)19)14(20)18(17-9)11-5-3-2-4-6-11/h2-7,20H,1H3,(H2,16,19)/p-1/b10-7+
InChIKey FOMOHQIQWHUFDL-JXMROGBWSA-M
Mol Weight 267.27 g/mol
Molecular Formula C14H11N4O2
Exact Mass 267.088201 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7wwr09mI5ME
Name 4-(trans-2-Carboxamido-2-cyano-ethenyl)-3-methyl-1-phenyl-pyrazolol-5 anion
Comments sodium salt
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H11N4O2
InChI InChI=1S/C14H12N4O2/c1-9-12(7-10(8-15)13(16)19)14(20)18(17-9)11-5-3-2-4-6-11/h2-7,20H,1H3,(H2,16,19)/p-1/b10-7+
InChIKey FOMOHQIQWHUFDL-JXMROGBWSA-M
Instrument Name Varian XL-100
Literature Reference H.H. Otto, H. Schmelz, Monatsh. Chem. 111, 53 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6