| SpectraBase Compound ID | AYFxPQZBoZo |
|---|---|
| InChI | InChI=1S/C12H10F7NO3/c1-22-6-3-4-7(8(5-6)23-2)20-9(21)10(13,14)11(15,16)12(17,18)19/h3-5H,1-2H3,(H,20,21) |
| InChIKey | AINRFKCOQWNUCA-UHFFFAOYSA-N |
| Mol Weight | 349.2 g/mol |
| Molecular Formula | C12H10F7NO3 |
| Exact Mass | 349.05489 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F9HzCrBBAUd |
|---|---|
| Name | Heptafluorobutyramide, N-(2,4-dimethoxyphenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 349.054890324 u |
| Formula | C12H10F7NO3 |
| InChI | InChI=1S/C12H10F7NO3/c1-22-6-3-4-7(8(5-6)23-2)20-9(21)10(13,14)11(15,16)12(17,18)19/h3-5H,1-2H3,(H,20,21) |
| InChIKey | AINRFKCOQWNUCA-UHFFFAOYSA-N |
| Molecular Weight | 349.205 g/mol |
| SMILES | C1(=C(C=CC(=C1)OC)NC(C(F)(F)C(F)(C(F)(F)F)F)=O)OC |