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Benzeneacetic acid, 4-[[(2-methyl-5-phenyl-3-furanyl)carbonyl]amino]-
SpectraBase Compound ID A3Sh4g8zODZ
InChI InChI=1S/C20H17NO4/c1-13-17(12-18(25-13)15-5-3-2-4-6-15)20(24)21-16-9-7-14(8-10-16)11-19(22)23/h2-10,12H,11H2,1H3,(H,21,24)(H,22,23)
InChIKey ZMJVHHYEDXRKOA-UHFFFAOYSA-N
Mol Weight 335.36 g/mol
Molecular Formula C20H17NO4
Exact Mass 335.115758 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AatjUiUpT6u
Name Benzeneacetic acid, 4-[[(2-methyl-5-phenyl-3-furanyl)carbonyl]amino]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.115758027 u
Formula C20H17NO4
InChI InChI=1S/C20H17NO4/c1-13-17(12-18(25-13)15-5-3-2-4-6-15)20(24)21-16-9-7-14(8-10-16)11-19(22)23/h2-10,12H,11H2,1H3,(H,21,24)(H,22,23)
InChIKey ZMJVHHYEDXRKOA-UHFFFAOYSA-N
Molecular Weight 335.359 g/mol
SMILES N(C(C=1C=C(C2=CC=CC=C2)OC1C)=O)C1=CC=C(CC(=O)O)C=C1