![3,4-dimethoxy-alpha-{[5-(trifluoromethyl)-2-pyridyl]sulfonyl}cinnamonitrile](/api/spectrum/JU2OWeIAtm7/structure.png?h=300&w=458 "3,4-dimethoxy-alpha-{[5-(trifluoromethyl)-2-pyridyl]sulfonyl}cinnamonitrile")
| SpectraBase Compound ID | KHTFE9XqbaW |
|---|---|
| InChI | InChI=1S/C17H13F3N2O4S/c1-25-14-5-3-11(8-15(14)26-2)7-13(9-21)27(23,24)16-6-4-12(10-22-16)17(18,19)20/h3-8,10H,1-2H3 |
| InChIKey | VPVFDPXOLXWRCZ-UHFFFAOYSA-N |
| Mol Weight | 398.36 g/mol |
| Molecular Formula | C17H13F3N2O4S |
| Exact Mass | 398.054813 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JU2OWeIAtm7 |
|---|---|
| Name | 3,4-dimethoxy-alpha-{[5-(trifluoromethyl)-2-pyridyl]sulfonyl}cinnamonitrile |
| Copyright | Copyright © 2009-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H13F3N2O4S |
| InChI | InChI=1S/C17H13F3N2O4S/c1-25-14-5-3-11(8-15(14)26-2)7-13(9-21)27(23,24)16-6-4-12(10-22-16)17(18,19)20/h3-8,10H,1-2H3 |
| InChIKey | VPVFDPXOLXWRCZ-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 57397M |
| Solvent | CDCl3 |