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N,5-dimethyl-3-(4-fluorophenyl)-4-isoxazolecarboxamide

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

N,5-dimethyl-3-(4-fluorophenyl)-4-isoxazolecarboxamide
SpectraBase Compound ID 1VsHt5wMEIz
InChI InChI=1S/C12H11FN2O2/c1-7-10(12(16)14-2)11(15-17-7)8-3-5-9(13)6-4-8/h3-6H,1-2H3,(H,14,16)
InChIKey DVDZYPBJVUNUKM-UHFFFAOYSA-N
Mol Weight 234.23 g/mol
Molecular Formula C12H11FN2O2
Exact Mass 234.080456 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6jrbHqLQtdc
Name N,5-dimethyl-3-(4-fluorophenyl)-4-isoxazolecarboxamide
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 243825
CAS Registry Number 67764-99-2
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11FN2O2
InChI InChI=1S/C12H11FN2O2/c1-7-10(12(16)14-2)11(15-17-7)8-3-5-9(13)6-4-8/h3-6H,1-2H3,(H,14,16)
InChIKey DVDZYPBJVUNUKM-UHFFFAOYSA-N
Observed nucleus 13C
Purity 99%
Solvent CDCl3 & DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_004034