![2-cyano-3-(p-fluoroanilino)-3-[(2,3,4,5,6-pentamethylbenzyl)thio]acrylamide](/api/spectrum/4M5Gu2o3mHL/structure.png?h=300&w=458 "2-cyano-3-(p-fluoroanilino)-3-[(2,3,4,5,6-pentamethylbenzyl)thio]acrylamide")
| SpectraBase Compound ID | E1xmmd8su2P |
|---|---|
| InChI | InChI=1S/C22H24FN3OS/c1-12-13(2)15(4)20(16(5)14(12)3)11-28-22(19(10-24)21(25)27)26-18-8-6-17(23)7-9-18/h6-9,26H,11H2,1-5H3,(H2,25,27) |
| InChIKey | FSDXYJNAMWBECO-UHFFFAOYSA-N |
| Mol Weight | 397.51 g/mol |
| Molecular Formula | C22H24FN3OS |
| Exact Mass | 397.162412 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4M5Gu2o3mHL |
|---|---|
| Name | 2-cyano-3-(p-fluoroanilino)-3-[(2,3,4,5,6-pentamethylbenzyl)thio]acrylamide |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H24FN3OS |
| InChI | InChI=1S/C22H24FN3OS/c1-12-13(2)15(4)20(16(5)14(12)3)11-28-22(19(10-24)21(25)27)26-18-8-6-17(23)7-9-18/h6-9,26H,11H2,1-5H3,(H2,25,27) |
| InChIKey | FSDXYJNAMWBECO-UHFFFAOYSA-N |
| Instrument Name | Varian A-60 |
| Sadtler NMR Number | 24783M |
| Solvent | DMSO-d6 |