| SpectraBase Compound ID | CZG8QwxZ2sy |
|---|---|
| InChI | InChI=1S/C7H5NOS/c9-7-5-3-1-2-4-6(5)8-10-7/h1-4,8H |
| InChIKey | DPBKQJOOSMJCFX-UHFFFAOYSA-N |
| Mol Weight | 151.18 g/mol |
| Molecular Formula | C7H5NOS |
| Exact Mass | 151.009185 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C5YAJ8C4Abw |
|---|---|
| Name | 2,1-BENZISOTHIAZOLIN-3-ONE |
| Source of Sample | A. Hardt, W. Bremser BASF Ludwigshafen (1982) |
| CAS Registry Number | 40352-87-2 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H5NOS |
| InChI | InChI=1S/C7H5NOS/c9-7-5-3-1-2-4-6(5)8-10-7/h1-4,8H |
| InChIKey | DPBKQJOOSMJCFX-UHFFFAOYSA-N |
| Molecular Weight | 151.19 |
| Solvent | Dimethyl sulfoxide-d6; Reference=TMS; Temperature=Ambient Spectrometer= Bruker WM-360 |