![4,8-Dimethylbenzo[1,2-D:4,5-D']bis[1,3]oxathiole-2,6-dithone](/api/spectrum/xWKzUEGH6v/structure.png?h=300&w=458 "4,8-Dimethylbenzo[1,2-D:4,5-D']bis[1,3]oxathiole-2,6-dithone")
| SpectraBase Compound ID | C1BgFTOWzjS |
|---|---|
| InChI | InChI=1S/C10H6O2S4/c1-3-5-8(16-9(13)11-5)4(2)6-7(3)15-10(14)12-6/h1-2H3 |
| InChIKey | UPMRCEPHSKKCHS-UHFFFAOYSA-N |
| Mol Weight | 286.4 g/mol |
| Molecular Formula | C10H6O2S4 |
| Exact Mass | 285.925064 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | xWKzUEGH6v |
|---|---|
| Name | 4,8-Dimethylbenzo[1,2-D:4,5-D']bis[1,3]oxathiole-2,6-dithone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 285.925064127 u |
| Formula | C10H6O2S4 |
| InChI | InChI=1S/C10H6O2S4/c1-3-5-8(16-9(13)11-5)4(2)6-7(3)15-10(14)12-6/h1-2H3 |
| InChIKey | UPMRCEPHSKKCHS-UHFFFAOYSA-N |
| SMILES | CC1=C2C(=C(C)C=3SC(=S)OC13)OC(=S)S2 |
| Spectrum/Structure Validation Score (Raman) | 0.787322 |