| SpectraBase Compound ID | 62IyuwQjnBU |
|---|---|
| InChI | InChI=1S/C8H5NO2S/c10-8(11)7-5-3-1-2-4-6(5)12-9-7/h1-4H,(H,10,11) |
| InChIKey | KTORKRBAIRTBCP-UHFFFAOYSA-N |
| Mol Weight | 179.19 g/mol |
| Molecular Formula | C8H5NO2S |
| Exact Mass | 179.0041 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 5azafmxjv0l |
|---|---|
| Name | 1,2-BENZISOTHIAZOLE-3-CARBOXYLIC ACID |
| Source of Sample | M. Davis, La Trobe University, Bundoora, Victoria, Australia |
| Comments | Tentative assignment |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H5NO2S |
| InChI | InChI=1S/C8H5NO2S/c10-8(11)7-5-3-1-2-4-6(5)12-9-7/h1-4H,(H,10,11) |
| InChIKey | KTORKRBAIRTBCP-UHFFFAOYSA-N |
| Melting Point | 143C |
| Molecular Weight | 179.20 |
| Solvent | Polysol; Reference=TMS Spectrometer= Varian CFT-20 |