| SpectraBase Compound ID | AWpzGtsHr0y |
|---|---|
| InChI | InChI=1S/C14H12O4S/c1-19(16,17)18-13-9-7-12(8-10-13)14(15)11-5-3-2-4-6-11/h2-10H,1H3 |
| InChIKey | UCYKCEOQFYKRAG-UHFFFAOYSA-N |
| Mol Weight | 276.31 g/mol |
| Molecular Formula | C14H12O4S |
| Exact Mass | 276.04563 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 42Ujb2oNPg3 |
|---|---|
| Name | Methanesulfonic acid (4-benzoylphenyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.045630036 u |
| Formula | C14H12O4S |
| InChI | InChI=1S/C14H12O4S/c1-19(16,17)18-13-9-7-12(8-10-13)14(15)11-5-3-2-4-6-11/h2-10H,1H3 |
| InChIKey | UCYKCEOQFYKRAG-UHFFFAOYSA-N |
| SMILES | C1(OS(=O)(=O)C)=CC=C(C(=O)C2=CC=CC=C2)C=C1 |