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3-[4-(2-Fluorophenyl)-1-piperazinyl]-1-(4-methoxyphenyl)-2,5-pyrrolidinedione

View entire compound with spectra: 2 NMR

3-[4-(2-Fluorophenyl)-1-piperazinyl]-1-(4-methoxyphenyl)-2,5-pyrrolidinedione
SpectraBase Compound ID LvDtAxQceDB
InChI InChI=1S/C21H22FN3O3/c1-28-16-8-6-15(7-9-16)25-20(26)14-19(21(25)27)24-12-10-23(11-13-24)18-5-3-2-4-17(18)22/h2-9,19H,10-14H2,1H3
InChIKey OVYZMTOCHPAMSK-UHFFFAOYSA-N
Mol Weight 383.42 g/mol
Molecular Formula C21H22FN3O3
Exact Mass 383.16452 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1vo5tgh4Yfd
Name 3-[4-(2-Fluorophenyl)-1-piperazinyl]-1-(4-methoxyphenyl)-2,5-pyrrolidinedione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 383.164519740 u
Formula C21H22FN3O3
InChI InChI=1S/C21H22FN3O3/c1-28-16-8-6-15(7-9-16)25-20(26)14-19(21(25)27)24-12-10-23(11-13-24)18-5-3-2-4-17(18)22/h2-9,19H,10-14H2,1H3
InChIKey OVYZMTOCHPAMSK-UHFFFAOYSA-N
Molecular Weight 383.423 g/mol
SMILES C1=CC=C(N2CCN(C3C(N(C(C3)=O)C3=CC=C(C=C3)OC)=O)CC2)C(F)=C1