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3-(o-chlorophenyl)-5-methyl-N-(alpha,2,4-trimethylbenzyl)-4-isoxazolecarboxamide

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3-(o-chlorophenyl)-5-methyl-N-(alpha,2,4-trimethylbenzyl)-4-isoxazolecarboxamide
SpectraBase Compound ID 7w2FtclYU4F
InChI InChI=1S/C21H21ClN2O2/c1-12-9-10-16(13(2)11-12)14(3)23-21(25)19-15(4)26-24-20(19)17-7-5-6-8-18(17)22/h5-11,14H,1-4H3,(H,23,25)
InChIKey MYYYETIMRQBGSF-UHFFFAOYSA-N
Mol Weight 368.86 g/mol
Molecular Formula C21H21ClN2O2
Exact Mass 368.129156 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FI64oxe0efg
Name 3-(o-CHLOROPHENYL)-5-METHYL-N-(alpha,2,4-TRIMETHYLBENZYL)-4-ISOXAZOLECARBOXAMIDE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21ClN2O2
InChI InChI=1S/C21H21ClN2O2/c1-12-9-10-16(13(2)11-12)14(3)23-21(25)19-15(4)26-24-20(19)17-7-5-6-8-18(17)22/h5-11,14H,1-4H3,(H,23,25)
InChIKey MYYYETIMRQBGSF-UHFFFAOYSA-N
Melting Point 120-122C
Molecular Weight 368.87
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 4-ISOXAZOLECARBOXAMIDE, 3-/O-CHLOROPHENYL/-5-METHYL-N-/A,2,4-TRIMETHYLBENZYL/-,