| SpectraBase Compound ID | 9e6cAgz8EgJ |
|---|---|
| InChI | InChI=1S/C9H8O3S/c10-8-5-6-13(11,12)9-4-2-1-3-7(8)9/h1-4H,5-6H2 |
| InChIKey | NNJAUTBXMFSABH-UHFFFAOYSA-N |
| Mol Weight | 196.22 g/mol |
| Molecular Formula | C9H8O3S |
| Exact Mass | 196.019415 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 31SOztklL6Y |
|---|---|
| Name | NNJAUTBXMFSABH-UHFFFAOYSA-N |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C9H8O3S |
| InChI | InChI=1S/C9H8O3S/c10-8-5-6-13(11,12)9-4-2-1-3-7(8)9/h1-4H,5-6H2 |
| InChIKey | NNJAUTBXMFSABH-UHFFFAOYSA-N |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2007) |
| Molecular Weight | 196.221 g/mol |
| Source File Reference | MHKO15329 |