| SpectraBase Compound ID | EFVrybW9cT |
|---|---|
| InChI | InChI=1S/C15H14S/c1-12-15(16-12,13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-12H,1H3 |
| InChIKey | WTUGFPGONISMCX-UHFFFAOYSA-N |
| Mol Weight | 226.34 g/mol |
| Molecular Formula | C15H14S |
| Exact Mass | 226.081622 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Hf4xdifUyS8 |
|---|---|
| Name | Thiirane, 3-methyl-2,2-diphenyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 226.081621625 u |
| Formula | C15H14S |
| InChI | InChI=1S/C15H14S/c1-12-15(16-12,13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-12H,1H3 |
| InChIKey | WTUGFPGONISMCX-UHFFFAOYSA-N |
| Molecular Weight | 226.337 g/mol |
| SMILES | C1(=CC=CC=C1)C1(C2=CC=CC=C2)SC1C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.971079 |