| SpectraBase Compound ID | 7AIXQ8wY5NB |
|---|---|
| InChI | InChI=1S/C13H19BrN2/c1-2-15-7-9-16(10-8-15)11-12-3-5-13(14)6-4-12/h3-6H,2,7-11H2,1H3 |
| InChIKey | DVDSQDKGMVJNFO-UHFFFAOYSA-N |
| Mol Weight | 283.21 g/mol |
| Molecular Formula | C13H19BrN2 |
| Exact Mass | 282.073162 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2IyfSPXSu5t |
|---|---|
| Name | 1-(4-Bromobenzyl)-4-ethylpiperazine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.073161620 u |
| Formula | C13H19BrN2 |
| InChI | InChI=1S/C13H19BrN2/c1-2-15-7-9-16(10-8-15)11-12-3-5-13(14)6-4-12/h3-6H,2,7-11H2,1H3 |
| InChIKey | DVDSQDKGMVJNFO-UHFFFAOYSA-N |
| SMILES | C(N1CCN(CC1)CC)C=1C=CC(=CC1)Br |