| SpectraBase Compound ID | EoDJeLvTYp4 |
|---|---|
| InChI | InChI=1S/C14H10FNOS/c1-18-11-7-5-10(6-8-11)17-14-4-2-3-13(15)12(14)9-16/h2-8H,1H3 |
| InChIKey | KIJMTRJIUKHLPE-UHFFFAOYSA-N |
| Mol Weight | 259.3 g/mol |
| Molecular Formula | C14H10FNOS |
| Exact Mass | 259.046713 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3tVvKpVP1wm |
|---|---|
| Name | 2-Fluoro-6-(4-(methylsulfanyl)phenoxy)benzonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 259.046713282 u |
| Formula | C14H10FNOS |
| InChI | InChI=1S/C14H10FNOS/c1-18-11-7-5-10(6-8-11)17-14-4-2-3-13(15)12(14)9-16/h2-8H,1H3 |
| InChIKey | KIJMTRJIUKHLPE-UHFFFAOYSA-N |
| Molecular Weight | 259.298 g/mol |
| SMILES | C1(=CC=C(C=C1)SC)OC1=C(C#N)C(F)=CC=C1 |