![3-{[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carboxamido}-6-nitrocoumarin](/api/spectrum/FCIPK28zeCd/structure.png?h=300&w=458 "3-{[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carboxamido}-6-nitrocoumarin")
| SpectraBase Compound ID | 1HENvKsTaeK |
|---|---|
| InChI | InChI=1S/C20H11ClFN3O6/c1-9-16(18(24-31-9)17-12(21)3-2-4-13(17)22)19(26)23-14-8-10-7-11(25(28)29)5-6-15(10)30-20(14)27/h2-8H,1H3,(H,23,26) |
| InChIKey | LJGCPQDGWLUHLN-UHFFFAOYSA-N |
| Mol Weight | 443.77 g/mol |
| Molecular Formula | C20H11ClFN3O6 |
| Exact Mass | 443.032041 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FCIPK28zeCd |
|---|---|
| Name | 3-{[3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl]carboxamido}-6-nitrocoumarin |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H11ClFN3O6 |
| InChI | InChI=1S/C20H11ClFN3O6/c1-9-16(18(24-31-9)17-12(21)3-2-4-13(17)22)19(26)23-14-8-10-7-11(25(28)29)5-6-15(10)30-20(14)27/h2-8H,1H3,(H,23,26) |
| InChIKey | LJGCPQDGWLUHLN-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 46795M |
| Solvent | DMSO-d6 |