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4-fluoro-N-(4-{2-[(4-fluorobenzoyl)amino]ethoxy}phenyl)benzamide
SpectraBase Compound ID 2ZEhjAmKRLH
InChI InChI=1S/C22H18F2N2O3/c23-17-5-1-15(2-6-17)21(27)25-13-14-29-20-11-9-19(10-12-20)26-22(28)16-3-7-18(24)8-4-16/h1-12H,13-14H2,(H,25,27)(H,26,28)
InChIKey VPDDBVDKVZFTBG-UHFFFAOYSA-N
Mol Weight 396.39 g/mol
Molecular Formula C22H18F2N2O3
Exact Mass 396.128549 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G4wtQADYLWc
Name 4-Fluoro-N-(4-{2-[(4-fluorobenzoyl)amino]ethoxy}phenyl)benzamide
Comments Computed using HOSE algorithm
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Exact Mass 396.128548771 u
Formula C22H18F2N2O3
InChI InChI=1S/C22H18F2N2O3/c23-17-5-1-15(2-6-17)21(27)25-13-14-29-20-11-9-19(10-12-20)26-22(28)16-3-7-18(24)8-4-16/h1-12H,13-14H2,(H,25,27)(H,26,28)
InChIKey VPDDBVDKVZFTBG-UHFFFAOYSA-N
Molecular Weight 396.394 g/mol
SMILES N(C(C1=CC=C(C=C1)F)=O)C=1C=CC(OCCNC(C2=CC=C(C=C2)F)=O)=CC1