| SpectraBase Compound ID | 8Rb7NHKC7i9 |
|---|---|
| InChI | InChI=1S/C9H12BrNO2S/c1-2-7-11-14(12,13)9-5-3-8(10)4-6-9/h3-6,11H,2,7H2,1H3 |
| InChIKey | CZRKEJQELXKHAQ-UHFFFAOYSA-N |
| Mol Weight | 278.16 g/mol |
| Molecular Formula | C9H12BrNO2S |
| Exact Mass | 276.977213 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5gXGZ4LHCOG |
|---|---|
| Name | 4-Bromo-N-propylbenzenesulfonamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.977212802 u |
| Formula | C9H12BrNO2S |
| InChI | InChI=1S/C9H12BrNO2S/c1-2-7-11-14(12,13)9-5-3-8(10)4-6-9/h3-6,11H,2,7H2,1H3 |
| InChIKey | CZRKEJQELXKHAQ-UHFFFAOYSA-N |
| SMILES | C(NS(=O)(=O)C1=CC=C(C=C1)Br)CC |