| SpectraBase Compound ID | 7aYbI0onZBy |
|---|---|
| InChI | InChI=1S/C9H18S2/c1-4-8(2)9(10-3)6-5-7-11-9/h8H,4-7H2,1-3H3 |
| InChIKey | KEWCYONKMKUHCF-UHFFFAOYSA-N |
| Mol Weight | 190.36 g/mol |
| Molecular Formula | C9H18S2 |
| Exact Mass | 190.084993 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IKlDcQBEBa2 |
|---|---|
| Name | 2-sec-Butyl-2-(methylthio)thiolane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.084992928 u |
| Formula | C9H18S2 |
| InChI | InChI=1S/C9H18S2/c1-4-8(2)9(10-3)6-5-7-11-9/h8H,4-7H2,1-3H3 |
| InChIKey | KEWCYONKMKUHCF-UHFFFAOYSA-N |
| Molecular Weight | 190.363 g/mol |
| SMILES | C1(SCCC1)(SC)C(CC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.950069 |