| SpectraBase Compound ID | JPWAIrVakZb |
|---|---|
| InChI | InChI=1S/C9H8N2O6S/c12-9-10(5-6-17-9)18(15,16)8-3-1-7(2-4-8)11(13)14/h1-4H,5-6H2 |
| InChIKey | BDZHIMCBPHWWHU-UHFFFAOYSA-N |
| Mol Weight | 272.23 g/mol |
| Molecular Formula | C9H8N2O6S |
| Exact Mass | 272.010307 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FsQeZNpyWaO |
|---|---|
| Name | Oxazolidin-2-one, 3-(4-nitrophenylsulfonyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.010307154 u |
| Formula | C9H8N2O6S |
| InChI | InChI=1S/C9H8N2O6S/c12-9-10(5-6-17-9)18(15,16)8-3-1-7(2-4-8)11(13)14/h1-4H,5-6H2 |
| InChIKey | BDZHIMCBPHWWHU-UHFFFAOYSA-N |
| SMILES | C1CN(S(C2=CC=C(C=C2)N(=O)=O)(=O)=O)C(O1)=O |