| SpectraBase Compound ID | C1h8kLJeA28 |
|---|---|
| InChI | InChI=1S/C15H16O3S/c1-3-13-6-8-14(9-7-13)18-19(16,17)15-10-4-12(2)5-11-15/h4-11H,3H2,1-2H3 |
| InChIKey | RAOSCIHUEBNRKV-UHFFFAOYSA-N |
| Mol Weight | 276.35 g/mol |
| Molecular Formula | C15H16O3S |
| Exact Mass | 276.082016 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7fc1NWLdOVG |
|---|---|
| Name | (4-Ethylphenyl) 4-methylbenzenesulfonate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.082015546 u |
| Formula | C15H16O3S |
| InChI | InChI=1S/C15H16O3S/c1-3-13-6-8-14(9-7-13)18-19(16,17)15-10-4-12(2)5-11-15/h4-11H,3H2,1-2H3 |
| InChIKey | RAOSCIHUEBNRKV-UHFFFAOYSA-N |
| Molecular Weight | 276.350 g/mol |
| SMILES | C=1(C=CC(=CC1)C)S(=O)(=O)OC=1C=CC(=CC1)CC |