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Benzoic acid, 4-[2-(2-fluorophenyl)-5-oxo-oxazol-4-ylidenemethyl]-
SpectraBase Compound ID 33zcZfMOTTp
InChI InChI=1S/C17H10FNO4/c18-13-4-2-1-3-12(13)15-19-14(17(22)23-15)9-10-5-7-11(8-6-10)16(20)21/h1-9H,(H,20,21)/b14-9+
InChIKey ZDXJNWPCKJTDQK-NTEUORMPSA-N
Mol Weight 311.27 g/mol
Molecular Formula C17H10FNO4
Exact Mass 311.059386 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IdzXCAGZKbG
Name Benzoic acid, 4-[2-(2-fluorophenyl)-5-oxo-oxazol-4-ylidenemethyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 311.059385965 u
Formula C17H10FNO4
InChI InChI=1S/C17H10FNO4/c18-13-4-2-1-3-12(13)15-19-14(17(22)23-15)9-10-5-7-11(8-6-10)16(20)21/h1-9H,(H,20,21)/b14-9+
InChIKey ZDXJNWPCKJTDQK-NTEUORMPSA-N
Molecular Weight 311.268 g/mol
SMILES C1(=N\C(=C\C=2C=CC(C(=O)O)=CC2)C(O1)=O)C=1C(F)=CC=CC1