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

View entire compound with spectra: 2 NMR

3-(2-chlorophenyl)-N-(2,4-dimethylphenyl)-5-methyl-4-isoxazolecarboxamide
SpectraBase Compound ID Aqhpg62HC02
InChI InChI=1S/C19H17ClN2O2/c1-11-8-9-16(12(2)10-11)21-19(23)17-13(3)24-22-18(17)14-6-4-5-7-15(14)20/h4-10H,1-3H3,(H,21,23)
InChIKey GTERTWFOKOCRGO-UHFFFAOYSA-N
Mol Weight 340.81 g/mol
Molecular Formula C19H17ClN2O2
Exact Mass 340.097855 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DQEHTjJ7jj2
Name 3-(2-Chlorophenyl)-N-(2,4-dimethylphenyl)-5-methyl-4-isoxazolecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 340.097855493 u
Formula C19H17ClN2O2
InChI InChI=1S/C19H17ClN2O2/c1-11-8-9-16(12(2)10-11)21-19(23)17-13(3)24-22-18(17)14-6-4-5-7-15(14)20/h4-10H,1-3H3,(H,21,23)
InChIKey GTERTWFOKOCRGO-UHFFFAOYSA-N
Molecular Weight 340.810 g/mol
SMILES N(C(C=1C(=NOC1C)C=1C(Cl)=CC=CC1)=O)C1=C(C=C(C=C1)C)C