| SpectraBase Compound ID | FszX9pCC8TH |
|---|---|
| InChI | InChI=1S/C13H13F3N4O5/c14-13(15,16)8-5-9(19(22)23)11(10(6-8)20(24)25)18-3-1-7(2-4-18)12(17)21/h5-7H,1-4H2,(H2,17,21) |
| InChIKey | BMTHFNSSRWVDKW-UHFFFAOYSA-N |
| Mol Weight | 362.27 g/mol |
| Molecular Formula | C13H13F3N4O5 |
| Exact Mass | 362.083804 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BGpxqCeJWAV |
|---|---|
| Name | 1-(2,6-dinitro-alpha,alpha,alpha-trifluoro-p-tolyl)isonipecotamide |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H13F3N4O5 |
| InChI | InChI=1S/C13H13F3N4O5/c14-13(15,16)8-5-9(19(22)23)11(10(6-8)20(24)25)18-3-1-7(2-4-18)12(17)21/h5-7H,1-4H2,(H2,17,21) |
| InChIKey | BMTHFNSSRWVDKW-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 48558M |
| Solvent | DMSO-d6 |