| SpectraBase Compound ID | 47TJFNkAtXG |
|---|---|
| InChI | InChI=1S/C9H11NO3S/c1-7(11)8-3-5-9(6-4-8)10-14(2,12)13/h3-6,10H,1-2H3 |
| InChIKey | BQBFGIIQPXLTKM-UHFFFAOYSA-N |
| Mol Weight | 213.25 g/mol |
| Molecular Formula | C9H11NO3S |
| Exact Mass | 213.045964 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8PXrrdQbIjP |
|---|---|
| Name | 4'-Acetylmethanesulfonanilide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 213.045964389 u |
| Formula | C9H11NO3S |
| InChI | InChI=1S/C9H11NO3S/c1-7(11)8-3-5-9(6-4-8)10-14(2,12)13/h3-6,10H,1-2H3 |
| InChIKey | BQBFGIIQPXLTKM-UHFFFAOYSA-N |
| Molecular Weight | 213.251 g/mol |
| SMILES | N(C1=CC=C(C=C1)C(C)=O)S(=O)(=O)C |