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4-Benzyl-1-{[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]carbonyl}piperidine

View entire compound with spectra: 2 NMR

4-Benzyl-1-{[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]carbonyl}piperidine
SpectraBase Compound ID IfHYf1olbKv
InChI InChI=1S/C23H22Cl2N2O2/c1-15-20(22(26-29-15)21-18(24)8-5-9-19(21)25)23(28)27-12-10-17(11-13-27)14-16-6-3-2-4-7-16/h2-9,17H,10-14H2,1H3
InChIKey GMPOFZSSHIQTCN-UHFFFAOYSA-N
Mol Weight 429.35 g/mol
Molecular Formula C23H22Cl2N2O2
Exact Mass 428.105833 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3rMEhWOY1ec
Name 4-Benzyl-1-{[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]carbonyl}piperidine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 428.105833354 u
Formula C23H22Cl2N2O2
InChI InChI=1S/C23H22Cl2N2O2/c1-15-20(22(26-29-15)21-18(24)8-5-9-19(21)25)23(28)27-12-10-17(11-13-27)14-16-6-3-2-4-7-16/h2-9,17H,10-14H2,1H3
InChIKey GMPOFZSSHIQTCN-UHFFFAOYSA-N
Molecular Weight 429.347 g/mol
SMILES C=1(C(=NOC1C)C=1C(Cl)=CC=CC1Cl)C(N1CCC(CC=2C=CC=CC2)CC1)=O