| SpectraBase Compound ID | LaPJK4sRDUU |
|---|---|
| InChI | InChI=1S/C6H10OS2/c1-5(7)6-2-3-8-4-9-6/h6H,2-4H2,1H3 |
| InChIKey | DWNXCCIIDMIDTO-UHFFFAOYSA-N |
| Mol Weight | 162.26 g/mol |
| Molecular Formula | C6H10OS2 |
| Exact Mass | 162.017307 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3ucndSAe0MC |
|---|---|
| Name | 1-(1,3-Dithian-4-yl)ethanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 162.017307289 u |
| Formula | C6H10OS2 |
| InChI | InChI=1S/C6H10OS2/c1-5(7)6-2-3-8-4-9-6/h6H,2-4H2,1H3 |
| InChIKey | DWNXCCIIDMIDTO-UHFFFAOYSA-N |
| SMILES | C1SCSC(C1)C(C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.904191 |