| SpectraBase Compound ID | DuuJyB3aYC3 |
|---|---|
| InChI | InChI=1S/C17H26O2S/c1-2-3-4-5-6-7-8-9-10-13-19-17(18)15-16-12-11-14-20-16/h2,11-12,14H,1,3-10,13,15H2 |
| InChIKey | MHZXYKBIACRRRK-UHFFFAOYSA-N |
| Mol Weight | 294.45 g/mol |
| Molecular Formula | C17H26O2S |
| Exact Mass | 294.165351 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BN7yZOcdLjz |
|---|---|
| Name | 2-Thiopheneacetic acid, undec-10-enyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.165351249 u |
| Formula | C17H26O2S |
| InChI | InChI=1S/C17H26O2S/c1-2-3-4-5-6-7-8-9-10-13-19-17(18)15-16-12-11-14-20-16/h2,11-12,14H,1,3-10,13,15H2 |
| InChIKey | MHZXYKBIACRRRK-UHFFFAOYSA-N |
| Molecular Weight | 294.453 g/mol |
| SMILES | C=CCCCCCCCCCOC(=O)CC=1SC=CC1 |