| SpectraBase Compound ID | 351laMAQWs2 |
|---|---|
| InChI | InChI=1S/C22H21Br2N/c1-17-4-2-3-5-20(17)16-25(14-18-6-10-21(23)11-7-18)15-19-8-12-22(24)13-9-19/h2-13H,14-16H2,1H3 |
| InChIKey | WEGKBLCRLWLHFJ-UHFFFAOYSA-N |
| Mol Weight | 459.23 g/mol |
| Molecular Formula | C22H21Br2N |
| Exact Mass | 457.004076 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BdwaKB4lXJP |
|---|---|
| Name | N,N-bis(4-Bromobenzyl)-N-(2-methylbenzyl)amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 457.004075680 u |
| Formula | C22H21Br2N |
| InChI | InChI=1S/C22H21Br2N/c1-17-4-2-3-5-20(17)16-25(14-18-6-10-21(23)11-7-18)15-19-8-12-22(24)13-9-19/h2-13H,14-16H2,1H3 |
| InChIKey | WEGKBLCRLWLHFJ-UHFFFAOYSA-N |
| Molecular Weight | 459.225 g/mol |
| SMILES | C(N(CC=1C=CC(=CC1)Br)CC=1C=CC(=CC1)Br)C=1C(=CC=CC1)C |