![1-[2-[2-(Butylthio)ethoxy]ethylthio]butane](/api/spectrum/6jO66UVPiec/structure.png?h=300&w=458 "1-[2-[2-(Butylthio)ethoxy]ethylthio]butane")
| SpectraBase Compound ID | HAYvZ3y39M9 |
|---|---|
| InChI | InChI=1S/C12H26OS2/c1-3-5-9-14-11-7-13-8-12-15-10-6-4-2/h3-12H2,1-2H3 |
| InChIKey | AXTRTEZVLIHDHR-UHFFFAOYSA-N |
| Mol Weight | 250.46 g/mol |
| Molecular Formula | C12H26OS2 |
| Exact Mass | 250.142508 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6jO66UVPiec |
|---|---|
| Name | 1-[2-[2-(Butylthio)ethoxy]ethylthio]butane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.142507804 u |
| Formula | C12H26OS2 |
| InChI | InChI=1S/C12H26OS2/c1-3-5-9-14-11-7-13-8-12-15-10-6-4-2/h3-12H2,1-2H3 |
| InChIKey | AXTRTEZVLIHDHR-UHFFFAOYSA-N |
| Molecular Weight | 250.459 g/mol |
| SMILES | C(SCCCC)COCCSCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.988313 |