| SpectraBase Compound ID | 1CbVvq80Lk |
|---|---|
| InChI | InChI=1S/C15H16O2S/c1-13(12-14-8-4-2-5-9-14)18(16,17)15-10-6-3-7-11-15/h2-11,13H,12H2,1H3 |
| InChIKey | BSTQPUOEARBORX-UHFFFAOYSA-N |
| Mol Weight | 260.35 g/mol |
| Molecular Formula | C15H16O2S |
| Exact Mass | 260.087101 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 382GPIHzBn5 |
|---|---|
| Name | 2-(Benzenesulfonyl)propylbenzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.087100927 u |
| Formula | C15H16O2S |
| InChI | InChI=1S/C15H16O2S/c1-13(12-14-8-4-2-5-9-14)18(16,17)15-10-6-3-7-11-15/h2-11,13H,12H2,1H3 |
| InChIKey | BSTQPUOEARBORX-UHFFFAOYSA-N |
| Molecular Weight | 260.351 g/mol |
| SMILES | C(S(=O)(=O)C=1C=CC=CC1)(CC1=CC=CC=C1)C |