![3-(2-chloro-6-fluorophenyl)-5-methyl-N-[1-(1-pyrrolidinyl)formimidoyl]-4-isoxazolecarboxamide](/api/spectrum/Ks0h0MLBM0s/structure.png?h=300&w=458 "3-(2-chloro-6-fluorophenyl)-5-methyl-N-[1-(1-pyrrolidinyl)formimidoyl]-4-isoxazolecarboxamide")
| SpectraBase Compound ID | b3fX0ufPVS |
|---|---|
| InChI | InChI=1S/C16H16ClFN4O2/c1-9-12(15(23)20-16(19)22-7-2-3-8-22)14(21-24-9)13-10(17)5-4-6-11(13)18/h4-6H,2-3,7-8H2,1H3,(H2,19,20,23) |
| InChIKey | BUCKZXUJLAZLPC-UHFFFAOYSA-N |
| Mol Weight | 350.78 g/mol |
| Molecular Formula | C16H16ClFN4O2 |
| Exact Mass | 350.094582 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ks0h0MLBM0s |
|---|---|
| Name | 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[1-(1-pyrrolidinyl)formimidoyl]-4-isoxazolecarboxamide |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H16ClFN4O2 |
| InChI | InChI=1S/C16H16ClFN4O2/c1-9-12(15(23)20-16(19)22-7-2-3-8-22)14(21-24-9)13-10(17)5-4-6-11(13)18/h4-6H,2-3,7-8H2,1H3,(H2,19,20,23) |
| InChIKey | BUCKZXUJLAZLPC-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 48262M |
| Solvent | DMSO-d6 |