| SpectraBase Compound ID | 4J3TvjVE5pg |
|---|---|
| InChI | InChI=1S/C9H9NO2S/c11-13(12)7-6-9(10-13)8-4-2-1-3-5-8/h1-5H,6-7H2 |
| InChIKey | PPMCBDIRCRRGLI-UHFFFAOYSA-N |
| Mol Weight | 195.24 g/mol |
| Molecular Formula | C9H9NO2S |
| Exact Mass | 195.0354 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 32mzg2z2AUg |
|---|---|
| Name | 3-Phenyl-4,5-dihydroisothiazole 1,1-dioxide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H9NO2S |
| InChI | InChI=1S/C9H9NO2S/c11-13(12)7-6-9(10-13)8-4-2-1-3-5-8/h1-5H,6-7H2 |
| InChIKey | PPMCBDIRCRRGLI-UHFFFAOYSA-N |
| Molecular Weight | 195.236 g/mol |
| SMILES | C1(=NS(CC1)(=O)=O)c1ccccc1 |
| SPLASH | splash10-0udi-1900000000-3d21dae8bd379a8817e2 |
| Source of Spectrum | F-62-1802-3 |
| Wiley ID | 1632356 |