| SpectraBase Compound ID | 5CzTH8agWTc |
|---|---|
| InChI | InChI=1S/C9H6N2O3S/c10-5-7-9(12)6-3-1-2-4-8(6)15(13,14)11-7/h1-4,11-12H |
| InChIKey | CLMNFPWRAQYFMU-UHFFFAOYSA-N |
| Mol Weight | 222.22 g/mol |
| Molecular Formula | C9H6N2O3S |
| Exact Mass | 222.009913 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CZjmpM7sJb3 |
|---|---|
| Name | 3-Cyano-4-hydroxy-1-thia-isoquinoline 1,1-dioxide |
| CAS Registry Number | 86061-85-0 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H6N2O3S |
| InChI | InChI=1S/C9H6N2O3S/c10-5-7-9(12)6-3-1-2-4-8(6)15(13,14)11-7/h1-4,11-12H |
| InChIKey | CLMNFPWRAQYFMU-UHFFFAOYSA-N |
| Instrument Name | Bruker AM-270 |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | DMSO-D6 |