| SpectraBase Compound ID | BZcOyvGIrOU |
|---|---|
| InChI | InChI=1S/C14H20BrNO/c1-2-3-4-9-14(17)16-11-10-12-7-5-6-8-13(12)15/h5-8H,2-4,9-11H2,1H3,(H,16,17) |
| InChIKey | ZGKNJBYQYKOZTR-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 | 1axHtwNjY1F |
|---|---|
| Name | 2-Bromophenethylamine hex |
| 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/c1-2-3-4-9-14(17)16-11-10-12-7-5-6-8-13(12)15/h5-8H,2-4,9-11H2,1H3,(H,16,17) |
| InChIKey | ZGKNJBYQYKOZTR-UHFFFAOYSA-N |
| Molecular Weight | 298.224 g/mol |
| SMILES | C=1(C(=CC=CC1)Br)CCNC(CCCCC)=O |