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3-(4-Benzoyl-1-piperazinyl)-1-(4-fluorophenyl)-2,5-pyrrolidinedione

View entire compound with spectra: 2 NMR

3-(4-Benzoyl-1-piperazinyl)-1-(4-fluorophenyl)-2,5-pyrrolidinedione
SpectraBase Compound ID EGWFoPVlLQR
InChI InChI=1S/C21H20FN3O3/c22-16-6-8-17(9-7-16)25-19(26)14-18(21(25)28)23-10-12-24(13-11-23)20(27)15-4-2-1-3-5-15/h1-9,18H,10-14H2
InChIKey GORKKKIUONGNEE-UHFFFAOYSA-N
Mol Weight 381.41 g/mol
Molecular Formula C21H20FN3O3
Exact Mass 381.14887 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1w4iDSU9XxE
Name 3-(4-Benzoyl-1-piperazinyl)-1-(4-fluorophenyl)-2,5-pyrrolidinedione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 381.148869676 u
Formula C21H20FN3O3
InChI InChI=1S/C21H20FN3O3/c22-16-6-8-17(9-7-16)25-19(26)14-18(21(25)28)23-10-12-24(13-11-23)20(27)15-4-2-1-3-5-15/h1-9,18H,10-14H2
InChIKey GORKKKIUONGNEE-UHFFFAOYSA-N
Molecular Weight 381.407 g/mol
SMILES C=1C=CC(C(N2CCN(C3C(N(C(C3)=O)C=3C=CC(=CC3)F)=O)CC2)=O)=CC1