| SpectraBase Compound ID | 3r2mhEUAAht |
|---|---|
| InChI | InChI=1S/C9H12O3S/c1-2-11-5-6-12-9(10)8-4-3-7-13-8/h3-4,7H,2,5-6H2,1H3 |
| InChIKey | STYAHBPOXYNMCW-UHFFFAOYSA-N |
| Mol Weight | 200.25 g/mol |
| Molecular Formula | C9H12O3S |
| Exact Mass | 200.050715 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6Xlfm0D9A61 |
|---|---|
| Name | 2-Thiophenecarboxylic acid, 2-ethoxyethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.050715417 u |
| Formula | C9H12O3S |
| InChI | InChI=1S/C9H12O3S/c1-2-11-5-6-12-9(10)8-4-3-7-13-8/h3-4,7H,2,5-6H2,1H3 |
| InChIKey | STYAHBPOXYNMCW-UHFFFAOYSA-N |
| Molecular Weight | 200.252 g/mol |
| SMILES | C(C1=CC=CS1)(=O)OCCOCC |