| SpectraBase Compound ID | 5cBYymwTJGh |
|---|---|
| InChI | InChI=1S/C12H16BrNO/c1-2-3-4-8-14-12(15)10-6-5-7-11(13)9-10/h5-7,9H,2-4,8H2,1H3,(H,14,15) |
| InChIKey | FPVZVKLBFHUYOM-UHFFFAOYSA-N |
| Mol Weight | 270.17 g/mol |
| Molecular Formula | C12H16BrNO |
| Exact Mass | 269.041527 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DptZJXSsia2 |
|---|---|
| Name | Benzamide, 3-bromo-N-pentyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 269.041527138 u |
| Formula | C12H16BrNO |
| InChI | InChI=1S/C12H16BrNO/c1-2-3-4-8-14-12(15)10-6-5-7-11(13)9-10/h5-7,9H,2-4,8H2,1H3,(H,14,15) |
| InChIKey | FPVZVKLBFHUYOM-UHFFFAOYSA-N |
| Molecular Weight | 270.170 g/mol |
| SMILES | C(NCCCCC)(=O)C=1C=CC=C(Br)C1 |