| SpectraBase Compound ID | EnknO18b4GM |
|---|---|
| InChI | InChI=1S/C8H5NOS/c10-7-5-3-1-2-4-6(5)8(11)9-7/h1-4H,(H,9,10,11) |
| InChIKey | PFEFOHMLVFUELJ-UHFFFAOYSA-N |
| Mol Weight | 163.19 g/mol |
| Molecular Formula | C8H5NOS |
| Exact Mass | 163.009185 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KhMZRDIhbim |
|---|---|
| Name | 3-Thioxoisoindolin-1-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H5NOS |
| InChI | InChI=1S/C8H5NOS/c10-7-5-3-1-2-4-6(5)8(11)9-7/h1-4H,(H,9,10,11) |
| InChIKey | PFEFOHMLVFUELJ-UHFFFAOYSA-N |
| Molecular Weight | 163.194 g/mol |
| SMILES | N1C(c2c(C1=O)cccc2)=S |
| SPLASH | splash10-0w4i-7900000000-cfebea97b9290c73d352 |
| Source of Spectrum | JX-2012-210 |
| Synonyms | 3-sulfanylidene-1-isoindolone |
| Wiley ID | 1660657 |