| SpectraBase Compound ID | G6WUAXeNOeh |
|---|---|
| InChI | InChI=1S/C20H16Br2ClN/c21-17-5-1-3-15(11-17)13-24(20-9-7-19(23)8-10-20)14-16-4-2-6-18(22)12-16/h1-12H,13-14H2 |
| InChIKey | MCYBFTHIJOHXHB-UHFFFAOYSA-N |
| Mol Weight | 465.62 g/mol |
| Molecular Formula | C20H16Br2ClN |
| Exact Mass | 462.933803 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | BP3N4rv15k6 |
|---|---|
| Name | N,N-bis(3-Bromobenzyl)-4-chloroaniline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 462.933803219 u |
| Formula | C20H16Br2ClN |
| InChI | InChI=1S/C20H16Br2ClN/c21-17-5-1-3-15(11-17)13-24(20-9-7-19(23)8-10-20)14-16-4-2-6-18(22)12-16/h1-12H,13-14H2 |
| InChIKey | MCYBFTHIJOHXHB-UHFFFAOYSA-N |
| Molecular Weight | 465.616 g/mol |
| SMILES | C1(N(CC=2C=C(C=CC2)Br)CC2=CC(=CC=C2)Br)=CC=C(C=C1)Cl |