For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

3-(2-chlorophenyl)-N-(3,4-dichlorobenzyl)-5-methyl-4-isoxazolecarboxamide

View entire compound with spectra: 2 NMR

3-(2-chlorophenyl)-N-(3,4-dichlorobenzyl)-5-methyl-4-isoxazolecarboxamide
SpectraBase Compound ID 61cipNEuoJm
InChI InChI=1S/C18H13Cl3N2O2/c1-10-16(17(23-25-10)12-4-2-3-5-13(12)19)18(24)22-9-11-6-7-14(20)15(21)8-11/h2-8H,9H2,1H3,(H,22,24)
InChIKey XLTISCJLIKQZLA-UHFFFAOYSA-N
Mol Weight 395.67 g/mol
Molecular Formula C18H13Cl3N2O2
Exact Mass 394.004261 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Lq3eoB1P7td
Name 3-(2-Chlorophenyl)-N-(3,4-dichlorobenzyl)-5-methyl-4-isoxazolecarboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 394.004260765 u
Formula C18H13Cl3N2O2
InChI InChI=1S/C18H13Cl3N2O2/c1-10-16(17(23-25-10)12-4-2-3-5-13(12)19)18(24)22-9-11-6-7-14(20)15(21)8-11/h2-8H,9H2,1H3,(H,22,24)
InChIKey XLTISCJLIKQZLA-UHFFFAOYSA-N
Molecular Weight 395.673 g/mol
SMILES N(C(C=1C(=NOC1C)C=1C(Cl)=CC=CC1)=O)CC1=CC(Cl)=C(C=C1)Cl