| SpectraBase Compound ID | 3e7PqoTV5mi |
|---|---|
| InChI | InChI=1S/C15H18BrNO/c16-13-6-4-5-12(11-13)9-10-15(18)17-14-7-2-1-3-8-14/h4-6,9-11,14H,1-3,7-8H2,(H,17,18)/b10-9+ |
| InChIKey | FFILVCOQTJBZMW-MDZDMXLPSA-N |
| Mol Weight | 308.22 g/mol |
| Molecular Formula | C15H18BrNO |
| Exact Mass | 307.057177 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DAO1TZ1HwYS |
|---|---|
| Name | 2-Propenamide, 3-(3-bromophenyl)-N-cyclohexyl-, (2E)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 307.057177203 u |
| Formula | C15H18BrNO |
| InChI | InChI=1S/C15H18BrNO/c16-13-6-4-5-12(11-13)9-10-15(18)17-14-7-2-1-3-8-14/h4-6,9-11,14H,1-3,7-8H2,(H,17,18)/b10-9+ |
| InChIKey | FFILVCOQTJBZMW-MDZDMXLPSA-N |
| SMILES | N(C(\C=C\C1=CC(Br)=CC=C1)=O)C1CCCCC1 |