| SpectraBase Compound ID | JBWSF8N4nFM |
|---|---|
| InChI | InChI=1S/C11H14O2S/c12-11(8-10-6-3-7-14-10)13-9-4-1-2-5-9/h3,6-7,9H,1-2,4-5,8H2 |
| InChIKey | LNWBSTXCRHSVSB-UHFFFAOYSA-N |
| Mol Weight | 210.29 g/mol |
| Molecular Formula | C11H14O2S |
| Exact Mass | 210.071451 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H7ZwwG35GC0 |
|---|---|
| Name | 2-Thiopheneacetic acid, cyclopentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.071450863 u |
| Formula | C11H14O2S |
| InChI | InChI=1S/C11H14O2S/c12-11(8-10-6-3-7-14-10)13-9-4-1-2-5-9/h3,6-7,9H,1-2,4-5,8H2 |
| InChIKey | LNWBSTXCRHSVSB-UHFFFAOYSA-N |
| Molecular Weight | 210.291 g/mol |
| SMILES | C1CC(OC(=O)CC=2SC=CC2)CC1 |