| SpectraBase Compound ID | FkOz6DQuqIA |
|---|---|
| InChI | InChI=1S/C15H14O2S/c16-18(17,15-11-5-2-6-12-15)13-7-10-14-8-3-1-4-9-14/h1-12H,13H2 |
| InChIKey | AWOQCRQDXFVJPL-UHFFFAOYSA-N |
| Mol Weight | 258.33 g/mol |
| Molecular Formula | C15H14O2S |
| Exact Mass | 258.071451 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 3urUbdWotD0 |
|---|---|
| Name | Cinnamyl phenyl sulfone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 258.071450863 u |
| Formula | C15H14O2S |
| InChI | InChI=1S/C15H14O2S/c16-18(17,15-11-5-2-6-12-15)13-7-10-14-8-3-1-4-9-14/h1-12H,13H2 |
| InChIKey | AWOQCRQDXFVJPL-UHFFFAOYSA-N |
| SMILES | C(C=1C=CC=CC1)=CCS(=O)(=O)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Raman) | 0.990861 |