| SpectraBase Compound ID | 8it03MRSUOM |
|---|---|
| InChI | InChI=1S/C7H6OS3/c1-5-2-3-6-7(4-5)10-11(8)9-6/h2-4H,1H3 |
| InChIKey | XVSHNNSBVMIJGJ-UHFFFAOYSA-N |
| Mol Weight | 202.3 g/mol |
| Molecular Formula | C7H6OS3 |
| Exact Mass | 201.958078 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AMsBIf1L4uU |
|---|---|
| Name | 5-Methyl-1,2,3-benzotrithiole 2-oxide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H6OS3 |
| InChI | InChI=1S/C7H6OS3/c1-5-2-3-6-7(4-5)10-11(8)9-6/h2-4H,1H3 |
| InChIKey | XVSHNNSBVMIJGJ-UHFFFAOYSA-N |
| Molecular Weight | 202.304 g/mol |
| SMILES | c12SS(Sc1ccc(c2)C)=O |
| SPLASH | splash10-0udi-0890000000-83f3d7f8a9f94898bcd1 |
| Source of Spectrum | KC-1993-1999-8 |
| Wiley ID | 779513 |