![3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(propylsulfonyl)-3-thienyl]-4-isoxazolecarboxamide](/api/spectrum/LNYfRH0H08S/structure.png?h=300&w=458 "3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(propylsulfonyl)-3-thienyl]-4-isoxazolecarboxamide")
| SpectraBase Compound ID | D9l3WONTqdT |
|---|---|
| InChI | InChI=1S/C18H16ClFN2O4S2/c1-3-7-28(24,25)14-9-27-8-13(14)21-18(23)15-10(2)26-22-17(15)16-11(19)5-4-6-12(16)20/h4-6,8-9H,3,7H2,1-2H3,(H,21,23) |
| InChIKey | QHVOMEMRCSEBSH-UHFFFAOYSA-N |
| Mol Weight | 442.91 g/mol |
| Molecular Formula | C18H16ClFN2O4S2 |
| Exact Mass | 442.022405 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LNYfRH0H08S |
|---|---|
| Name | 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(propylsulfonyl)-3-thienyl]-4-isoxazolecarboxamide |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H16ClFN2O4S2 |
| InChI | InChI=1S/C18H16ClFN2O4S2/c1-3-7-28(24,25)14-9-27-8-13(14)21-18(23)15-10(2)26-22-17(15)16-11(19)5-4-6-12(16)20/h4-6,8-9H,3,7H2,1-2H3,(H,21,23) |
| InChIKey | QHVOMEMRCSEBSH-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 58487M |
| Solvent | CDCl3 |