| SpectraBase Compound ID | CDvLKfPMfPr |
|---|---|
| InChI | InChI=1S/C12H10OS/c1-9-4-6-10(7-5-9)12(13)11-3-2-8-14-11/h2-8H,1H3 |
| InChIKey | IKWYWMSVSMGHEU-UHFFFAOYSA-N |
| Mol Weight | 202.27 g/mol |
| Molecular Formula | C12H10OS |
| Exact Mass | 202.045236 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DBGxKdKZjdf |
|---|---|
| Name | 2-Thienyl p-tolyl ketone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 202.045236115 u |
| Formula | C12H10OS |
| InChI | InChI=1S/C12H10OS/c1-9-4-6-10(7-5-9)12(13)11-3-2-8-14-11/h2-8H,1H3 |
| InChIKey | IKWYWMSVSMGHEU-UHFFFAOYSA-N |
| Molecular Weight | 202.271 g/mol |
| SMILES | C=1C(=CC=C(C1)C)C(C=1SC=CC1)=O |