| SpectraBase Compound ID | Djq6NNH3WNw |
|---|---|
| InChI | InChI=1S/C10H12O2S/c11-10(9-6-3-7-13-9)12-8-4-1-2-5-8/h3,6-8H,1-2,4-5H2 |
| InChIKey | QBKZRDRXJRWLDI-UHFFFAOYSA-N |
| Mol Weight | 196.26 g/mol |
| Molecular Formula | C10H12O2S |
| Exact Mass | 196.055801 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1zHw3a2YGCM |
|---|---|
| Name | 2-Thiophenecarboxylic acid, cyclopentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.055800798 u |
| Formula | C10H12O2S |
| InChI | InChI=1S/C10H12O2S/c11-10(9-6-3-7-13-9)12-8-4-1-2-5-8/h3,6-8H,1-2,4-5H2 |
| InChIKey | QBKZRDRXJRWLDI-UHFFFAOYSA-N |
| Molecular Weight | 196.264 g/mol |
| SMILES | C1C(CCC1)OC(=O)C=1SC=CC1 |