| SpectraBase Compound ID | GDpJjSi5W0O |
|---|---|
| InChI | InChI=1S/C14H14OS/c15-16(11-13-7-3-1-4-8-13)12-14-9-5-2-6-10-14/h1-10H,11-12H2 |
| InChIKey | HTMQZWFSTJVJEQ-UHFFFAOYSA-N |
| Mol Weight | 230.32 g/mol |
| Molecular Formula | C14H14OS |
| Exact Mass | 230.076536 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 785uX30vZw2 |
|---|---|
| Name | Dibenzylsulfoxid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 230.076536244 u |
| Formula | C14H14OS |
| InChI | InChI=1S/C14H14OS/c15-16(11-13-7-3-1-4-8-13)12-14-9-5-2-6-10-14/h1-10H,11-12H2 |
| InChIKey | HTMQZWFSTJVJEQ-UHFFFAOYSA-N |
| Molecular Weight | 230.325 g/mol |
| SMILES | C(S(=O)CC1=CC=CC=C1)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Raman) | 0.989993 |