| SpectraBase Compound ID | Ax1L0QlJwwF |
|---|---|
| InChI | InChI=1S/C13H13F3N4O5/c14-13(15,16)7-5-9(19(22)23)11(10(6-7)20(24)25)18-8-3-1-2-4-17-12(8)21/h5-6,8,18H,1-4H2,(H,17,21) |
| InChIKey | HHYZNTQFJBNUSS-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 | Dn3cIbUpZfS |
|---|---|
| Name | 3-(2,6-dinitro-alpha,alpha,alpha-trifluoro-p-toluidino)hexahydro-2H-azepin-2-one |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H13F3N4O5 |
| InChI | InChI=1S/C13H13F3N4O5/c14-13(15,16)7-5-9(19(22)23)11(10(6-7)20(24)25)18-8-3-1-2-4-17-12(8)21/h5-6,8,18H,1-4H2,(H,17,21) |
| InChIKey | HHYZNTQFJBNUSS-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 56383M |
| Solvent | CDCl3 |