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6-Bromo-4-[(4-ethyl-1-piperazinyl)carbonyl]-2-(3-methylphenyl)quinoline

View entire compound with spectra: 2 NMR

6-Bromo-4-[(4-ethyl-1-piperazinyl)carbonyl]-2-(3-methylphenyl)quinoline
SpectraBase Compound ID CCNeoeMzGUA
InChI InChI=1S/C23H24BrN3O/c1-3-26-9-11-27(12-10-26)23(28)20-15-22(17-6-4-5-16(2)13-17)25-21-8-7-18(24)14-19(20)21/h4-8,13-15H,3,9-12H2,1-2H3
InChIKey MMPUWQRCSKZSRX-UHFFFAOYSA-N
Mol Weight 438.37 g/mol
Molecular Formula C23H24BrN3O
Exact Mass 437.110275 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4euJdAcPfDE
Name 6-Bromo-4-[(4-ethyl-1-piperazinyl)carbonyl]-2-(3-methylphenyl)quinoline
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 437.110275404 u
Formula C23H24BrN3O
InChI InChI=1S/C23H24BrN3O/c1-3-26-9-11-27(12-10-26)23(28)20-15-22(17-6-4-5-16(2)13-17)25-21-8-7-18(24)14-19(20)21/h4-8,13-15H,3,9-12H2,1-2H3
InChIKey MMPUWQRCSKZSRX-UHFFFAOYSA-N
Molecular Weight 438.369 g/mol
SMILES C1(C(N2CCN(CC2)CC)=O)=C2C(C=CC(=C2)Br)=NC(=C1)C1=CC(C)=CC=C1