| SpectraBase Compound ID | 8GaA9z6HjLZ |
|---|---|
| InChI | InChI=1S/C14H20BrNO/c1-3-10-16(14(17)12(2)15)11-9-13-7-5-4-6-8-13/h4-8,12H,3,9-11H2,1-2H3 |
| InChIKey | JJYIDSRBQBWPFV-UHFFFAOYSA-N |
| Mol Weight | 298.22 g/mol |
| Molecular Formula | C14H20BrNO |
| Exact Mass | 297.072827 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G3s5XIF6Vq0 |
|---|---|
| Name | Propanamide, 2-bromo-N-(2-phenylethyl)-N-propyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 297.072827267 u |
| Formula | C14H20BrNO |
| InChI | InChI=1S/C14H20BrNO/c1-3-10-16(14(17)12(2)15)11-9-13-7-5-4-6-8-13/h4-8,12H,3,9-11H2,1-2H3 |
| InChIKey | JJYIDSRBQBWPFV-UHFFFAOYSA-N |
| Molecular Weight | 298.224 g/mol |
| SMILES | C1=CC=CC(=C1)CCN(C(=O)C(Br)C)CCC |