| SpectraBase Compound ID | CURKWwgzcK5 |
|---|---|
| InChI | InChI=1S/C10H12BrNO/c1-2-7-12-10(13)8-3-5-9(11)6-4-8/h3-6H,2,7H2,1H3,(H,12,13) |
| InChIKey | HFHYZJDMVOCWSV-UHFFFAOYSA-N |
| Mol Weight | 242.12 g/mol |
| Molecular Formula | C10H12BrNO |
| Exact Mass | 241.010227 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | jWALCvJM8I |
|---|---|
| Name | 4-Bromo-N-propylbenzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 241.010227009 u |
| Formula | C10H12BrNO |
| InChI | InChI=1S/C10H12BrNO/c1-2-7-12-10(13)8-3-5-9(11)6-4-8/h3-6H,2,7H2,1H3,(H,12,13) |
| InChIKey | HFHYZJDMVOCWSV-UHFFFAOYSA-N |
| Molecular Weight | 242.116 g/mol |
| SMILES | C1(Br)=CC=C(C=C1)C(=O)NCCC |