| SpectraBase Compound ID | IV9v75IPTT7 |
|---|---|
| InChI | InChI=1S/C13H12O2S/c1-10-6-8-11(9-7-10)16(15)13-5-3-2-4-12(13)14/h2-9,14H,1H3 |
| InChIKey | BCVJKHSUQNUYQH-UHFFFAOYSA-N |
| Mol Weight | 232.3 g/mol |
| Molecular Formula | C13H12O2S |
| Exact Mass | 232.055801 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2cuJSwhVO1I |
|---|---|
| Name | o-(p-Tolylsulfinyl)phenol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.055800798 u |
| Formula | C13H12O2S |
| InChI | InChI=1S/C13H12O2S/c1-10-6-8-11(9-7-10)16(15)13-5-3-2-4-12(13)14/h2-9,14H,1H3 |
| InChIKey | BCVJKHSUQNUYQH-UHFFFAOYSA-N |
| Molecular Weight | 232.297 g/mol |
| SMILES | OC=1C(=CC=CC1)S(C=1C=CC(=CC1)C)=O |