| SpectraBase Compound ID | CUkzO4lLx36 |
|---|---|
| InChI | InChI=1S/C9H20O2S/c1-5-10-9(11-6-2)7-12-8(3)4/h8-9H,5-7H2,1-4H3 |
| InChIKey | QWZQIOJCGMZEDG-UHFFFAOYSA-N |
| Mol Weight | 192.32 g/mol |
| Molecular Formula | C9H20O2S |
| Exact Mass | 192.118401 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 40mBop3BKcA |
|---|---|
| Name | 2-Isopropylthioacetaldehyde diethylacetal |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 192.118401056 u |
| Formula | C9H20O2S |
| InChI | InChI=1S/C9H20O2S/c1-5-10-9(11-6-2)7-12-8(3)4/h8-9H,5-7H2,1-4H3 |
| InChIKey | QWZQIOJCGMZEDG-UHFFFAOYSA-N |
| Molecular Weight | 192.317 g/mol |
| SMILES | C(SC(C)C)C(OCC)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.964728 |