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3Z-(4-Chloro-anilino)-2-cyano-propenoic acid, ethyl ester
SpectraBase Compound ID 4tNTqR27G3p
InChI InChI=1S/C12H11ClN2O2/c1-2-17-12(16)9(7-14)8-15-11-5-3-10(13)4-6-11/h3-6,8,15H,2H2,1H3/b9-8-
InChIKey NTWSIYWETNCLJO-HJWRWDBZSA-N
Mol Weight 250.68 g/mol
Molecular Formula C12H11ClN2O2
Exact Mass 250.050905 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EwTw9kewHnz
Name 3Z-(4-Chloro-anilino)-2-cyano-propenoic acid, ethyl ester
CAS Registry Number 59746-99-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H11ClN2O2
InChI InChI=1S/C12H11ClN2O2/c1-2-17-12(16)9(7-14)8-15-11-5-3-10(13)4-6-11/h3-6,8,15H,2H2,1H3/b9-8-
InChIKey NTWSIYWETNCLJO-HJWRWDBZSA-N
Instrument Name Tesla BS477
Literature Reference M. Michalik, Z. Chem. 26, 104 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6