| SpectraBase Compound ID | KWECE7nNfJv |
|---|---|
| InChI | InChI=1S/C15H12O2S3/c1-2-17-15(16)14-8-7-13(20-14)12-6-5-11(19-12)10-4-3-9-18-10/h3-9H,2H2,1H3 |
| InChIKey | RFBKGGGRWCASGY-UHFFFAOYSA-N |
| Mol Weight | 320.44 g/mol |
| Molecular Formula | C15H12O2S3 |
| Exact Mass | 319.999943 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8OkEp8fQvdD |
|---|---|
| Name | 5-Ethoxycarbonyl-2,2':5',2''-terthiophene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 319.999943146 u |
| Formula | C15H12O2S3 |
| InChI | InChI=1S/C15H12O2S3/c1-2-17-15(16)14-8-7-13(20-14)12-6-5-11(19-12)10-4-3-9-18-10/h3-9H,2H2,1H3 |
| InChIKey | RFBKGGGRWCASGY-UHFFFAOYSA-N |
| Molecular Weight | 320.439 g/mol |
| SMILES | C=1(SC(=CC1)C(=O)OCC)C=1SC(C=2SC=CC2)=CC1 |