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4-{[4-(2,3-Dimethylphenyl)-1-piperazinyl]carbonyl}-2-(2-methylphenyl)quinoline

View entire compound with spectra: 2 NMR

4-{[4-(2,3-Dimethylphenyl)-1-piperazinyl]carbonyl}-2-(2-methylphenyl)quinoline
SpectraBase Compound ID CzdNxTWOGZ3
InChI InChI=1S/C29H29N3O/c1-20-10-8-14-28(22(20)3)31-15-17-32(18-16-31)29(33)25-19-27(23-11-5-4-9-21(23)2)30-26-13-7-6-12-24(25)26/h4-14,19H,15-18H2,1-3H3
InChIKey QFJARZOLRRJCFT-UHFFFAOYSA-N
Mol Weight 435.57 g/mol
Molecular Formula C29H29N3O
Exact Mass 435.231063 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3LWC9y03dep
Name 4-{[4-(2,3-Dimethylphenyl)-1-piperazinyl]carbonyl}-2-(2-methylphenyl)quinoline
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 435.231062565 u
Formula C29H29N3O
InChI InChI=1S/C29H29N3O/c1-20-10-8-14-28(22(20)3)31-15-17-32(18-16-31)29(33)25-19-27(23-11-5-4-9-21(23)2)30-26-13-7-6-12-24(25)26/h4-14,19H,15-18H2,1-3H3
InChIKey QFJARZOLRRJCFT-UHFFFAOYSA-N
Molecular Weight 435.571 g/mol
SMILES C=1(C(N2CCN(CC2)C2=C(C(C)=CC=C2)C)=O)C=C(C2=C(C)C=CC=C2)N=C2C1C=CC=C2