| SpectraBase Compound ID | LfHBpbDVe0G |
|---|---|
| InChI | InChI=1S/C7H16OS/c1-6(2)7(5-9)3-4-8/h6-9H,3-5H2,1-2H3 |
| InChIKey | IVKAQGSNAPORPA-UHFFFAOYSA-N |
| Mol Weight | 148.26 g/mol |
| Molecular Formula | C7H16OS |
| Exact Mass | 148.092186 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | F51U4O0bZpY |
|---|---|
| Name | 2-(Hydroxyethyl) isoamyl sulfide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 148.092186308 u |
| Formula | C7H16OS |
| InChI | InChI=1S/C7H16OS/c1-6(2)7(5-9)3-4-8/h6-9H,3-5H2,1-2H3 |
| InChIKey | IVKAQGSNAPORPA-UHFFFAOYSA-N |
| Molecular Weight | 148.264 g/mol |
| SMILES | C(S)C(C(C)C)CCO |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.850387 |