| SpectraBase Compound ID | 3xYJJ1jOJ3T |
|---|---|
| InChI | InChI=1S/C17H18BrNO/c1-2-11-19(13-14-7-4-3-5-8-14)17(20)15-9-6-10-16(18)12-15/h3-10,12H,2,11,13H2,1H3 |
| InChIKey | QAOQXLMTBIJDPL-UHFFFAOYSA-N |
| Mol Weight | 332.24 g/mol |
| Molecular Formula | C17H18BrNO |
| Exact Mass | 331.057177 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BFjirF1sgqd |
|---|---|
| Name | Benzamide, 3-bromo-N-benzyl-N-propyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 331.057177203 u |
| Formula | C17H18BrNO |
| InChI | InChI=1S/C17H18BrNO/c1-2-11-19(13-14-7-4-3-5-8-14)17(20)15-9-6-10-16(18)12-15/h3-10,12H,2,11,13H2,1H3 |
| InChIKey | QAOQXLMTBIJDPL-UHFFFAOYSA-N |
| Molecular Weight | 332.241 g/mol |
| SMILES | C(N(CCC)CC1=CC=CC=C1)(=O)C=1C=C(C=CC1)Br |