| SpectraBase Compound ID | 9Wed4gPtPB |
|---|---|
| InChI | InChI=1S/C13H18N2O4S/c1-3-4-5-13(17)15-20(18,19)12-8-6-11(7-9-12)14-10(2)16/h6-9H,3-5H2,1-2H3,(H,14,16)(H,15,17) |
| InChIKey | QQMBMORKGDMHTE-UHFFFAOYSA-N |
| Mol Weight | 298.36 g/mol |
| Molecular Formula | C13H18N2O4S |
| Exact Mass | 298.098728 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6A19mYY7WIy |
|---|---|
| Name | N-(4-Acetamidophenyl)sulfonylpentanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.098728238 u |
| Formula | C13H18N2O4S |
| InChI | InChI=1S/C13H18N2O4S/c1-3-4-5-13(17)15-20(18,19)12-8-6-11(7-9-12)14-10(2)16/h6-9H,3-5H2,1-2H3,(H,14,16)(H,15,17) |
| InChIKey | QQMBMORKGDMHTE-UHFFFAOYSA-N |
| SMILES | C=1(S(NC(CCCC)=O)(=O)=O)C=CC(NC(C)=O)=CC1 |