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4-{[4-(4-Fluorophenyl)-1-piperazinyl]carbonyl}-2-(4-methoxyphenyl)quinoline

View entire compound with spectra: 2 NMR

4-{[4-(4-Fluorophenyl)-1-piperazinyl]carbonyl}-2-(4-methoxyphenyl)quinoline
SpectraBase Compound ID An62w51ifQS
InChI InChI=1S/C27H24FN3O2/c1-33-22-12-6-19(7-13-22)26-18-24(23-4-2-3-5-25(23)29-26)27(32)31-16-14-30(15-17-31)21-10-8-20(28)9-11-21/h2-13,18H,14-17H2,1H3
InChIKey MKRIZLUGGARBOR-UHFFFAOYSA-N
Mol Weight 441.51 g/mol
Molecular Formula C27H24FN3O2
Exact Mass 441.185255 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5rlTe5YRf5Z
Name 4-{[4-(4-Fluorophenyl)-1-piperazinyl]carbonyl}-2-(4-methoxyphenyl)quinoline
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 441.185255186 u
Formula C27H24FN3O2
InChI InChI=1S/C27H24FN3O2/c1-33-22-12-6-19(7-13-22)26-18-24(23-4-2-3-5-25(23)29-26)27(32)31-16-14-30(15-17-31)21-10-8-20(28)9-11-21/h2-13,18H,14-17H2,1H3
InChIKey MKRIZLUGGARBOR-UHFFFAOYSA-N
Molecular Weight 441.506 g/mol
SMILES C=1(C(N2CCN(CC2)C2=CC=C(C=C2)F)=O)C=C(C=2C=CC(=CC2)OC)N=C2C1C=CC=C2