| SpectraBase Compound ID | K5XQ8if5eN |
|---|---|
| InChI | InChI=1S/C11H7FO2S/c12-8-4-1-2-5-9(8)14-11(13)10-6-3-7-15-10/h1-7H |
| InChIKey | FRYWOAXUDQBSIQ-UHFFFAOYSA-N |
| Mol Weight | 222.23 g/mol |
| Molecular Formula | C11H7FO2S |
| Exact Mass | 222.015079 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3TCD0uHQtfZ |
|---|---|
| Name | Thiophene-2-carboxylic acid, 2-fluorophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.015078800 u |
| Formula | C11H7FO2S |
| InChI | InChI=1S/C11H7FO2S/c12-8-4-1-2-5-9(8)14-11(13)10-6-3-7-15-10/h1-7H |
| InChIKey | FRYWOAXUDQBSIQ-UHFFFAOYSA-N |
| Molecular Weight | 222.233 g/mol |
| SMILES | C1(=CC=CS1)C(OC1=CC=CC=C1F)=O |