| SpectraBase Compound ID | 93oXcwbAOnl |
|---|---|
| InChI | InChI=1S/C12H10OS2/c13-12(10-4-2-1-3-5-10)9-15-11-6-7-14-8-11/h1-8H,9H2 |
| InChIKey | AMBJTSMXKJBWKY-UHFFFAOYSA-N |
| Mol Weight | 234.33 g/mol |
| Molecular Formula | C12H10OS2 |
| Exact Mass | 234.017307 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KJHLpCCU8Tq |
|---|---|
| Name | 1-Phenyl-2-(thiophen-3-ylsulfanyl)ethanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.017307289 u |
| Formula | C12H10OS2 |
| InChI | InChI=1S/C12H10OS2/c13-12(10-4-2-1-3-5-10)9-15-11-6-7-14-8-11/h1-8H,9H2 |
| InChIKey | AMBJTSMXKJBWKY-UHFFFAOYSA-N |
| Molecular Weight | 234.331 g/mol |
| SMILES | C1=CC(=CC=C1)C(CSC=1C=CSC1)=O |