![[1,4,7]Trithiecane 4,4-dioxide](/api/spectrum/HXscIE9ihH2/structure.png?h=300&w=458 "[1,4,7]Trithiecane 4,4-dioxide")
| SpectraBase Compound ID | Gwhdafg7O1E |
|---|---|
| InChI | InChI=1S/C7H14O2S3/c8-12(9)6-4-10-2-1-3-11-5-7-12/h1-7H2 |
| InChIKey | CNDKNTUXTBYKHK-UHFFFAOYSA-N |
| Mol Weight | 226.37 g/mol |
| Molecular Formula | C7H14O2S3 |
| Exact Mass | 226.015593 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HXscIE9ihH2 |
|---|---|
| Name | [1,4,7]Trithiecane 4,4-dioxide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H14O2S3 |
| InChI | InChI=1S/C7H14O2S3/c8-12(9)6-4-10-2-1-3-11-5-7-12/h1-7H2 |
| InChIKey | CNDKNTUXTBYKHK-UHFFFAOYSA-N |
| Molecular Weight | 226.367 g/mol |
| SMILES | C1CSCCS(CCSC1)(=O)=O |
| SPLASH | splash10-0a7l-9410000000-a2a802649caf32aa3acd |
| Wiley ID | 1485751 |