| SpectraBase Compound ID | 6N3j3pXGyZx |
|---|---|
| InChI | InChI=1S/C9H7NS3/c1-12-9-10-7-5-3-2-4-6(7)8(11)13-9/h2-5H,1H3 |
| InChIKey | WQQUEIHTVJFLRC-UHFFFAOYSA-N |
| Mol Weight | 225.34 g/mol |
| Molecular Formula | C9H7NS3 |
| Exact Mass | 224.974063 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | J6K85uZiv09 |
|---|---|
| Name | 2-(methylthio)-3,1-benzothiazine-4-thione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H7NS3 |
| InChI | InChI=1S/C9H7NS3/c1-12-9-10-7-5-3-2-4-6(7)8(11)13-9/h2-5H,1H3 |
| InChIKey | WQQUEIHTVJFLRC-UHFFFAOYSA-N |
| Molecular Weight | 225.342 g/mol |
| SMILES | C1(=Nc2c(C(S1)=S)cccc2)SC |
| SPLASH | splash10-004i-0940000000-b6157da133d897cadf31 |
| Source of Spectrum | Y-39-1033-19 |
| Synonyms | 2-Methylsulfanyl-3,1-benzothiazine-4-thione |
| Wiley ID | 1528637 |