| SpectraBase Compound ID | AEr7HHhLSiK |
|---|---|
| InChI | InChI=1S/C11H16OS/c1-11(2,3)13-10-8-6-5-7-9(10)12-4/h5-8H,1-4H3 |
| InChIKey | QEORNIGQDCMPGG-UHFFFAOYSA-N |
| Mol Weight | 196.31 g/mol |
| Molecular Formula | C11H16OS |
| Exact Mass | 196.092186 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3pYer41HC75 |
|---|---|
| Name | 1-(Tert-butylthio)-2-methoxy-benzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.092186308 u |
| Formula | C11H16OS |
| InChI | InChI=1S/C11H16OS/c1-11(2,3)13-10-8-6-5-7-9(10)12-4/h5-8H,1-4H3 |
| InChIKey | QEORNIGQDCMPGG-UHFFFAOYSA-N |
| Molecular Weight | 196.308 g/mol |
| SMILES | CC(C)(C)SC1=C(OC)C=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.895873 |