| SpectraBase Compound ID | 6xK5LmYYn9Z |
|---|---|
| InChI | InChI=1S/C11H8OS2/c12-11(10-7-4-8-13-10)14-9-5-2-1-3-6-9/h1-8H |
| InChIKey | XZYGCCMNPDMMIU-UHFFFAOYSA-N |
| Mol Weight | 220.3 g/mol |
| Molecular Formula | C11H8OS2 |
| Exact Mass | 220.001657 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EIOLGx74yiZ |
|---|---|
| Name | S-Phenyl 2-thiophenecarbothioate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.001657225 u |
| Formula | C11H8OS2 |
| InChI | InChI=1S/C11H8OS2/c12-11(10-7-4-8-13-10)14-9-5-2-1-3-6-9/h1-8H |
| InChIKey | XZYGCCMNPDMMIU-UHFFFAOYSA-N |
| Molecular Weight | 220.304 g/mol |
| SMILES | C(C=1SC=CC1)(SC=1C=CC=CC1)=O |