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(E/Z)-2-(Benzoylamino)-3-(3-methyl-5-phenylisoxzol-4-yl)propenoic acid

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(E/Z)-2-(Benzoylamino)-3-(3-methyl-5-phenylisoxzol-4-yl)propenoic acid
SpectraBase Compound ID 4wMjDgLojzW
InChI InChI=1S/C20H16N2O4/c1-13-16(18(26-22-13)14-8-4-2-5-9-14)12-17(20(24)25)21-19(23)15-10-6-3-7-11-15/h2-12H,1H3,(H,21,23)(H,24,25)/b17-12+
InChIKey SLIHSJUUJCQELT-SFQUDFHCSA-N
Mol Weight 348.36 g/mol
Molecular Formula C20H16N2O4
Exact Mass 348.111007 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 397wnbY0zUj
Name (E/Z)-2-(Benzoylamino)-3-(3-methyl-5-phenylisoxzol-4-yl)propenoic acid
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 348.111006999 u
Formula C20H16N2O4
InChI InChI=1S/C20H16N2O4/c1-13-16(18(26-22-13)14-8-4-2-5-9-14)12-17(20(24)25)21-19(23)15-10-6-3-7-11-15/h2-12H,1H3,(H,21,23)(H,24,25)/b17-12+
InChIKey SLIHSJUUJCQELT-SFQUDFHCSA-N
Molecular Weight 348.358 g/mol
SMILES C1(=C(ON=C1C)C1=CC=CC=C1)\C=C/(NC(=O)C1=CC=CC=C1)C(=O)O