| SpectraBase Compound ID | HinwpmU8Kug |
|---|---|
| InChI | InChI=1S/C8H8N2O5S/c11-8(6-10(12)13)9-16(14,15)7-4-2-1-3-5-7/h1-5H,6H2,(H,9,11) |
| InChIKey | PNDBVHWREIUHCY-UHFFFAOYSA-N |
| Mol Weight | 244.22 g/mol |
| Molecular Formula | C8H8N2O5S |
| Exact Mass | 244.015393 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KCH54rYW4AZ |
|---|---|
| Name | N-Phenylsulfonyl-2-nitroacetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 244.015392535 u |
| Formula | C8H8N2O5S |
| InChI | InChI=1S/C8H8N2O5S/c11-8(6-10(12)13)9-16(14,15)7-4-2-1-3-5-7/h1-5H,6H2,(H,9,11) |
| InChIKey | PNDBVHWREIUHCY-UHFFFAOYSA-N |
| Molecular Weight | 244.221 g/mol |
| SMILES | C(NS(=O)(=O)C=1C=CC=CC1)(CN(=O)=O)=O |