| SpectraBase Compound ID | 6emQdYU85EH |
|---|---|
| InChI | InChI=1S/C4H10S2/c5-3-1-2-4-6/h5-6H,1-4H2 |
| InChIKey | SMTOKHQOVJRXLK-UHFFFAOYSA-N |
| Mol Weight | 122.24 g/mol |
| Molecular Formula | C4H10S2 |
| Exact Mass | 122.022393 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | EmZJSQF16pC |
|---|---|
| Name | 1,4-Butanedithiol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 122.022392670 u |
| Formula | C4H10S2 |
| InChI | InChI=1S/C4H10S2/c5-3-1-2-4-6/h5-6H,1-4H2 |
| InChIKey | SMTOKHQOVJRXLK-UHFFFAOYSA-N |
| Molecular Weight | 122.244 g/mol |
| SMILES | SCCCCS |
| Spectrum/Structure Validation Score (Raman) | 0.938269 |