![Benzenesulfonamide, N-[2-(4-morpholinyl)ethyl]-4-nitro-](/api/spectrum/JCyUBaWjrdN/structure.png?h=300&w=458 "Benzenesulfonamide, N-[2-(4-morpholinyl)ethyl]-4-nitro-")
| SpectraBase Compound ID | BO6kCv9BTPk |
|---|---|
| InChI | InChI=1S/C12H17N3O5S/c16-15(17)11-1-3-12(4-2-11)21(18,19)13-5-6-14-7-9-20-10-8-14/h1-4,13H,5-10H2 |
| InChIKey | WKRFRVXMMMLBEY-UHFFFAOYSA-N |
| Mol Weight | 315.34 g/mol |
| Molecular Formula | C12H17N3O5S |
| Exact Mass | 315.088892 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JCyUBaWjrdN |
|---|---|
| Name | Benzenesulfonamide, N-[2-(4-morpholinyl)ethyl]-4-nitro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.088891828 u |
| Formula | C12H17N3O5S |
| InChI | InChI=1S/C12H17N3O5S/c16-15(17)11-1-3-12(4-2-11)21(18,19)13-5-6-14-7-9-20-10-8-14/h1-4,13H,5-10H2 |
| InChIKey | WKRFRVXMMMLBEY-UHFFFAOYSA-N |
| Molecular Weight | 315.344 g/mol |
| SMILES | C1(N(=O)=O)=CC=C(C=C1)S(=O)(=O)NCCN1CCOCC1 |