| SpectraBase Compound ID | K2pwfbDousm |
|---|---|
| InChI | InChI=1S/C8H10OS/c1-9-7-4-3-5-8(6-7)10-2/h3-6H,1-2H3 |
| InChIKey | IWVQVOXDIOKVBE-UHFFFAOYSA-N |
| Mol Weight | 154.23 g/mol |
| Molecular Formula | C8H10OS |
| Exact Mass | 154.045236 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3ub9WNc14Vy |
|---|---|
| Name | 1-Methoxy-3-methylthio-benzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 154.045236115 u |
| Formula | C8H10OS |
| InChI | InChI=1S/C8H10OS/c1-9-7-4-3-5-8(6-7)10-2/h3-6H,1-2H3 |
| InChIKey | IWVQVOXDIOKVBE-UHFFFAOYSA-N |
| Molecular Weight | 154.227 g/mol |
| SMILES | CSC1=CC(OC)=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.864922 |