| SpectraBase Compound ID | 1uQmtJmj5Ai |
|---|---|
| InChI | InChI=1S/C7H4O3S/c8-4-1-2-5-6(3-4)11-7(9)10-5/h1-3,8H |
| InChIKey | HDSYJLOFQVPBJM-UHFFFAOYSA-N |
| Mol Weight | 168.17 g/mol |
| Molecular Formula | C7H4O3S |
| Exact Mass | 167.988115 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | EjXXUEBshAz |
|---|---|
| Name | 5-HYDROXY-1,3-BENZOXATHIOL-2-ONE |
| Source of Sample | H. Fiedler, University of Rostock, Rostock, Germany |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H4O3S |
| InChI | InChI=1S/C7H4O3S/c8-4-1-2-5-6(3-4)11-7(9)10-5/h1-3,8H |
| InChIKey | HDSYJLOFQVPBJM-UHFFFAOYSA-N |
| Melting Point | 175.5-176C |
| Molecular Weight | 168.17 |
| Solvent | Polysol; Reference=TMS Spectrometer= Varian CFT-20 |
| Synonyms | 1,3-BENZOXATHIOL-2-ONE, 5-HYDROXY-, |