| SpectraBase Compound ID | 6xWvmx0hL62 |
|---|---|
| InChI | InChI=1S/C14H22O2S/c1-3-5-7-12(4-2)11-16-14(15)10-13-8-6-9-17-13/h6,8-9,12H,3-5,7,10-11H2,1-2H3 |
| InChIKey | FMJWKQWCUIRLJS-UHFFFAOYSA-N |
| Mol Weight | 254.39 g/mol |
| Molecular Formula | C14H22O2S |
| Exact Mass | 254.134051 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ADBDSh4PAf |
|---|---|
| Name | 2-Thiopheneacetic acid, 2-ethylhexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.134051120 u |
| Formula | C14H22O2S |
| InChI | InChI=1S/C14H22O2S/c1-3-5-7-12(4-2)11-16-14(15)10-13-8-6-9-17-13/h6,8-9,12H,3-5,7,10-11H2,1-2H3 |
| InChIKey | FMJWKQWCUIRLJS-UHFFFAOYSA-N |
| Molecular Weight | 254.388 g/mol |
| SMILES | CCC(CCCC)COC(=O)CC=1SC=CC1 |