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Methyl 2-({4-[(2,3,5,6-tetrafluorophenoxy)methyl]benzoyl}amino)benzoate

View entire compound with spectra: 2 NMR

Methyl 2-({4-[(2,3,5,6-tetrafluorophenoxy)methyl]benzoyl}amino)benzoate
SpectraBase Compound ID F4Purl299Lt
InChI InChI=1S/C22H15F4NO4/c1-30-22(29)14-4-2-3-5-17(14)27-21(28)13-8-6-12(7-9-13)11-31-20-18(25)15(23)10-16(24)19(20)26/h2-10H,11H2,1H3,(H,27,28)
InChIKey OHHKDVUMQBIXGM-UHFFFAOYSA-N
Mol Weight 433.36 g/mol
Molecular Formula C22H15F4NO4
Exact Mass 433.093721 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CcyZhZ3Sdm1
Name Methyl 2-({4-[(2,3,5,6-tetrafluorophenoxy)methyl]benzoyl}amino)benzoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 433.093720615 u
Formula C22H15F4NO4
InChI InChI=1S/C22H15F4NO4/c1-30-22(29)14-4-2-3-5-17(14)27-21(28)13-8-6-12(7-9-13)11-31-20-18(25)15(23)10-16(24)19(20)26/h2-10H,11H2,1H3,(H,27,28)
InChIKey OHHKDVUMQBIXGM-UHFFFAOYSA-N
Molecular Weight 433.359 g/mol
SMILES N(C(C1=CC=C(COC2=C(C(F)=CC(=C2F)F)F)C=C1)=O)C1=C(C(=O)OC)C=CC=C1