| SpectraBase Compound ID | CKo1zvsGY2N |
|---|---|
| InChI | InChI=1S/C6H6N2O4S/c1-13(11,12)6-3-2-5(4-7-6)8(9)10/h2-4H,1H3 |
| InChIKey | UZLCJZWEVGHUMC-UHFFFAOYSA-N |
| Mol Weight | 202.18 g/mol |
| Molecular Formula | C6H6N2O4S |
| Exact Mass | 202.004828 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9fDFYTVeUzK |
|---|---|
| Name | 2-Methylsulfonyl-5-nitropyridine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 202.004827851 u |
| Formula | C6H6N2O4S |
| InChI | InChI=1S/C6H6N2O4S/c1-13(11,12)6-3-2-5(4-7-6)8(9)10/h2-4H,1H3 |
| InChIKey | UZLCJZWEVGHUMC-UHFFFAOYSA-N |
| Molecular Weight | 202.184 g/mol |
| SMILES | c1(S(=O)(=O)C)ncc(N(=O)=O)cc1 |