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2-ethoxy-4-[(E)-(2-(4-fluorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene)methyl]phenyl 2-methylpropanoate
SpectraBase Compound ID 9DryzwOgAoF
InChI InChI=1S/C22H20FNO5/c1-4-27-19-12-14(5-10-18(19)28-21(25)13(2)3)11-17-22(26)29-20(24-17)15-6-8-16(23)9-7-15/h5-13H,4H2,1-3H3/b17-11+
InChIKey FRSULEGEJPMISE-GZTJUZNOSA-N
Mol Weight 397.4 g/mol
Molecular Formula C22H20FNO5
Exact Mass 397.132551 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7pNl9OUx7kr
Name 2-Ethoxy-4-[(E)-(2-(4-fluorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene)methyl]phenyl 2-methylpropanoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 397.132550906 u
Formula C22H20FNO5
InChI InChI=1S/C22H20FNO5/c1-4-27-19-12-14(5-10-18(19)28-21(25)13(2)3)11-17-22(26)29-20(24-17)15-6-8-16(23)9-7-15/h5-13H,4H2,1-3H3/b17-11+
InChIKey FRSULEGEJPMISE-GZTJUZNOSA-N
Molecular Weight 397.402 g/mol
SMILES CCOC1=CC(\C=C/2N=C(OC2=O)C2=CC=C(F)C=C2)=CC=C1OC(=O)C(C)C