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2-[2-(4-fluorophenyl)-2-oxoethyl]-4-phenyl-1(2H)-phthalazinone

View entire compound with spectra: 2 NMR

2-[2-(4-fluorophenyl)-2-oxoethyl]-4-phenyl-1(2H)-phthalazinone
SpectraBase Compound ID 26IDk0iTsQ8
InChI InChI=1S/C22H15FN2O2/c23-17-12-10-15(11-13-17)20(26)14-25-22(27)19-9-5-4-8-18(19)21(24-25)16-6-2-1-3-7-16/h1-13H,14H2
InChIKey BKMKKKGHKGAFHK-UHFFFAOYSA-N
Mol Weight 358.37 g/mol
Molecular Formula C22H15FN2O2
Exact Mass 358.111756 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CgpJxTecCaf
Name 2-[2-(4-Fluorophenyl)-2-oxoethyl]-4-phenyl-1(2H)-phthalazinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 358.111755892 u
Formula C22H15FN2O2
InChI InChI=1S/C22H15FN2O2/c23-17-12-10-15(11-13-17)20(26)14-25-22(27)19-9-5-4-8-18(19)21(24-25)16-6-2-1-3-7-16/h1-13H,14H2
InChIKey BKMKKKGHKGAFHK-UHFFFAOYSA-N
Molecular Weight 358.372 g/mol
SMILES C1=CC=C(C2=NN(C(C=3C2=CC=CC3)=O)CC(C2=CC=C(C=C2)F)=O)C=C1