| SpectraBase Compound ID | 5JROjybA7y1 |
|---|---|
| InChI | InChI=1S/C11H14O2S/c1-12-10-6-3-2-5-9(10)11-13-7-4-8-14-11/h2-3,5-6,11H,4,7-8H2,1H3 |
| InChIKey | RTZPJFYYKQZCND-UHFFFAOYSA-N |
| Mol Weight | 210.29 g/mol |
| Molecular Formula | C11H14O2S |
| Exact Mass | 210.071451 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CyFFUoFVwMq |
|---|---|
| Name | 2-(o-Methoxyphenyl)-1,3-oxathiane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.071450863 u |
| Formula | C11H14O2S |
| InChI | InChI=1S/C11H14O2S/c1-12-10-6-3-2-5-9(10)11-13-7-4-8-14-11/h2-3,5-6,11H,4,7-8H2,1H3 |
| InChIKey | RTZPJFYYKQZCND-UHFFFAOYSA-N |
| Molecular Weight | 210.291 g/mol |
| SMILES | C1(OCCCS1)C=1C(=CC=CC1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.81472 |