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2-CYANO-3-(2-HYDROXY-5-METHOXYPHENYL)-PROP-2-ENE-1-CARBOXAMIDE
SpectraBase Compound ID 9pHbYLI45eI
InChI InChI=1S/C11H10N2O3/c1-16-9-2-3-10(14)7(5-9)4-8(6-12)11(13)15/h2-5,14H,1H3,(H2,13,15)/b8-4+
InChIKey PDOCBMOBFNPPME-XBXARRHUSA-N
Mol Weight 218.21 g/mol
Molecular Formula C11H10N2O3
Exact Mass 218.069142 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5iwxfpOE9j4
Name 2-CYANO-3-(2-HYDROXY-5-METHOXYPHENYL)-PROP-2-ENE-1-CARBOXAMIDE
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H10N2O3
InChI InChI=1S/C11H10N2O3/c1-16-9-2-3-10(14)7(5-9)4-8(6-12)11(13)15/h2-5,14H,1H3,(H2,13,15)/b8-4+
InChIKey PDOCBMOBFNPPME-XBXARRHUSA-N
Literature Reference Author C.N.O'CALLAGHAN,T.B.H.MCMURRY,J.E.O'BRIEN
Literature Reference Citation J.CHEM.SOC.PERKIN-2,425(1998)
Literature Reference DOI 10.1039/js8732600425
Molecular Weight 218.212 g/mol
Solvent DMSO-D6
Source File Reference UWRU12027