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3-(2,6-dichlorophenyl)-N,N-dicyclohexyl-5-methyl-4-isoxazolecarboxamide

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3-(2,6-dichlorophenyl)-N,N-dicyclohexyl-5-methyl-4-isoxazolecarboxamide
SpectraBase Compound ID HApWtOrMOUq
InChI InChI=1S/C23H28Cl2N2O2/c1-15-20(22(26-29-15)21-18(24)13-8-14-19(21)25)23(28)27(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h8,13-14,16-17H,2-7,9-12H2,1H3
InChIKey OVCGNMCMXLDXNJ-UHFFFAOYSA-N
Mol Weight 435.4 g/mol
Molecular Formula C23H28Cl2N2O2
Exact Mass 434.152784 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LiE0d5wAvg0
Name 3-(2,6-Dichlorophenyl)-N,N-dicyclohexyl-5-methyl-4-isoxazolecarboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 434.152783548 u
Formula C23H28Cl2N2O2
InChI InChI=1S/C23H28Cl2N2O2/c1-15-20(22(26-29-15)21-18(24)13-8-14-19(21)25)23(28)27(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h8,13-14,16-17H,2-7,9-12H2,1H3
InChIKey OVCGNMCMXLDXNJ-UHFFFAOYSA-N
Molecular Weight 435.395 g/mol
SMILES C1C(CCCC1)N(C(C1=C(ON=C1C=1C(=CC=CC1Cl)Cl)C)=O)C1CCCCC1