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HRBVVSOFSLPAOY-JXMROGBWSA-N
SpectraBase Compound ID Jbq5aZIV77t
InChI InChI=1S/C12H11NO3/c1-2-16-12(15)10(8-13)7-9-3-5-11(14)6-4-9/h3-7,14H,2H2,1H3/b10-7+
InChIKey HRBVVSOFSLPAOY-JXMROGBWSA-N
Mol Weight 217.22 g/mol
Molecular Formula C12H11NO3
Exact Mass 217.073893 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID OiCBnnozhq
Name (E)-A-Cyano-4-hydroxy-cinnamic acid, ethyl ester
CAS Registry Number 6935-44-0
Comments CHEMICAL SHIFT OF C2 CHANGED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H11NO3
InChI InChI=1S/C12H11NO3/c1-2-16-12(15)10(8-13)7-9-3-5-11(14)6-4-9/h3-7,14H,2H2,1H3/b10-7+
InChIKey HRBVVSOFSLPAOY-JXMROGBWSA-N
Instrument Name Bruker WP-80
Literature Reference F.A. Bottino, G. Musumarra, Z. Rappoport, Magn. Res. Chem. 24, 31 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6