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3-(o-chlorophenyl)-N-(3,4-dimethoxyphenethyl)-5-methyl-1-isoxazolecarboxamide

View entire compound with spectra: 3 NMR, and 1 FTIR

3-(o-chlorophenyl)-N-(3,4-dimethoxyphenethyl)-5-methyl-1-isoxazolecarboxamide
SpectraBase Compound ID 9n8mbfg0Wii
InChI InChI=1S/C21H21ClN2O4/c1-13-19(20(24-28-13)15-6-4-5-7-16(15)22)21(25)23-11-10-14-8-9-17(26-2)18(12-14)27-3/h4-9,12H,10-11H2,1-3H3,(H,23,25)
InChIKey CMQWPEHUZVHBHP-UHFFFAOYSA-N
Mol Weight 400.86 g/mol
Molecular Formula C21H21ClN2O4
Exact Mass 400.118985 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A8u0VKkKubf
Name 3-(o-CHLOROPHENYL)-N-(3,4-DIMETHOXYPHENETHYL)-5-METHYL-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 C21H21ClN2O4
InChI InChI=1S/C21H21ClN2O4/c1-13-19(20(24-28-13)15-6-4-5-7-16(15)22)21(25)23-11-10-14-8-9-17(26-2)18(12-14)27-3/h4-9,12H,10-11H2,1-3H3,(H,23,25)
InChIKey CMQWPEHUZVHBHP-UHFFFAOYSA-N
Melting Point 131-132C
Molecular Weight 400.87
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 4-ISOXAZOLECARBOXAMIDE, 3-/O-CHLOROPHENYL/-N-/3,4-DIMETHOXYPHENETHYL/- 5-METHYL-,