| SpectraBase Compound ID | EuxnVGRNMSo |
|---|---|
| InChI | InChI=1S/C14H11FN2O/c1-9-7-10(2)17-14(13(9)8-16)18-12-5-3-11(15)4-6-12/h3-7H,1-2H3 |
| InChIKey | ZEMVGGBUGZVYQY-UHFFFAOYSA-N |
| Mol Weight | 242.25 g/mol |
| Molecular Formula | C14H11FN2O |
| Exact Mass | 242.085541 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FMWRVrlYzn6 |
|---|---|
| Name | 2-(4-Fluoro-phenoxy)-4,6-dimethyl-nicotinonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 242.085541144 u |
| Formula | C14H11FN2O |
| InChI | InChI=1S/C14H11FN2O/c1-9-7-10(2)17-14(13(9)8-16)18-12-5-3-11(15)4-6-12/h3-7H,1-2H3 |
| InChIKey | ZEMVGGBUGZVYQY-UHFFFAOYSA-N |
| Molecular Weight | 242.253 g/mol |
| SMILES | C1(=C(C(C)=CC(=N1)C)C#N)OC=1C=CC(=CC1)F |