| SpectraBase Compound ID | K77Egj3JMLZ |
|---|---|
| InChI | InChI=1S/C15H11ClFN3O5S/c1-8-13(14(19-25-8)15(21)24-2)12-5-6-18-20(12)26(22,23)9-3-4-11(17)10(16)7-9/h3-7H,1-2H3 |
| InChIKey | RMRXPWXGULURCC-UHFFFAOYSA-N |
| Mol Weight | 399.78 g/mol |
| Molecular Formula | C15H11ClFN3O5S |
| Exact Mass | 399.009197 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 774YPNNJbjK |
|---|---|
| Name | 4-{1-[(3-chloro-4-fluorophenyl)sulfonyl-5-yl}-5-methyl-3-isoxazolecarboxylic acid, methyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H11ClFN3O5S |
| InChI | InChI=1S/C15H11ClFN3O5S/c1-8-13(14(19-25-8)15(21)24-2)12-5-6-18-20(12)26(22,23)9-3-4-11(17)10(16)7-9/h3-7H,1-2H3 |
| InChIKey | RMRXPWXGULURCC-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 61278M |
| Solvent | CDCl3 |