![N-[4-({[1-(hydroxymethyl)propyl]amino}sulfonyl)phenyl]acetamide](/api/spectrum/CmKkxyqNGBW/structure.png?h=300&w=458 "N-[4-({[1-(hydroxymethyl)propyl]amino}sulfonyl)phenyl]acetamide")
| SpectraBase Compound ID | 5ASZdpfq7xU |
|---|---|
| InChI | InChI=1S/C12H18N2O4S/c1-3-10(8-15)14-19(17,18)12-6-4-11(5-7-12)13-9(2)16/h4-7,10,14-15H,3,8H2,1-2H3,(H,13,16) |
| InChIKey | SFRGDEGBGQJQCB-UHFFFAOYSA-N |
| Mol Weight | 286.35 g/mol |
| Molecular Formula | C12H18N2O4S |
| Exact Mass | 286.098728 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CmKkxyqNGBW |
|---|---|
| Name | N-[4-({[1-(hydroxymethyl)propyl]amino}sulfonyl)phenyl]acetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 286.098728238 u |
| Formula | C12H18N2O4S |
| InChI | InChI=1S/C12H18N2O4S/c1-3-10(8-15)14-19(17,18)12-6-4-11(5-7-12)13-9(2)16/h4-7,10,14-15H,3,8H2,1-2H3,(H,13,16) |
| InChIKey | SFRGDEGBGQJQCB-UHFFFAOYSA-N |
| Molecular Weight | 286.346 g/mol |
| SMILES | N(S(C=1C=CC(NC(=O)C)=CC1)(=O)=O)C(CO)CC |