| SpectraBase Compound ID | 7H1ADpaPmls |
|---|---|
| InChI | InChI=1S/C3H8O4S2/c1-8(4,5)3-9(2,6)7/h3H2,1-2H3 |
| InChIKey | VDPDRYUUTXEEIE-UHFFFAOYSA-N |
| Mol Weight | 172.21 g/mol |
| Molecular Formula | C3H8O4S2 |
| Exact Mass | 171.986401 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 74azEk4U7Eg |
|---|---|
| Name | bis-Methylsulphonyl-methane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 171.986401082 u |
| Formula | C3H8O4S2 |
| InChI | InChI=1S/C3H8O4S2/c1-8(4,5)3-9(2,6)7/h3H2,1-2H3 |
| InChIKey | VDPDRYUUTXEEIE-UHFFFAOYSA-N |
| SMILES | C(S(=O)(C)=O)S(C)(=O)=O |
| Spectrum/Structure Validation Score (Raman) | 0.929433 |