| SpectraBase Compound ID | 2YI3MXyNSTi |
|---|---|
| InChI | InChI=1S/C9H12FNO2S/c1-2-7-11-14(12,13)9-5-3-8(10)4-6-9/h3-6,11H,2,7H2,1H3 |
| InChIKey | MTBBWACEQXVMRS-UHFFFAOYSA-N |
| Mol Weight | 217.26 g/mol |
| Molecular Formula | C9H12FNO2S |
| Exact Mass | 217.057278 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LE691aRX5sJ |
|---|---|
| Name | 4-Fluoro-N-propyl-benzenesulfonamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 217.057277965 u |
| Formula | C9H12FNO2S |
| InChI | InChI=1S/C9H12FNO2S/c1-2-7-11-14(12,13)9-5-3-8(10)4-6-9/h3-6,11H,2,7H2,1H3 |
| InChIKey | MTBBWACEQXVMRS-UHFFFAOYSA-N |
| Molecular Weight | 217.258 g/mol |
| SMILES | C1(F)=CC=C(C=C1)S(=O)(=O)NCCC |