| SpectraBase Compound ID | 7mRn2TtHmVT |
|---|---|
| InChI | InChI=1S/C16H16Br2N2O2/c1-20(2)10-16(21)19-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-9H,10H2,1-2H3,(H,19,21) |
| InChIKey | KZQZFOFYKMSENU-UHFFFAOYSA-N |
| Mol Weight | 428.12 g/mol |
| Molecular Formula | C16H16Br2N2O2 |
| Exact Mass | 425.957854 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LjhT8OtIgyg |
|---|---|
| Name | 2,4-Dibromo-4'-(2-dimethylaminoacetamido)diphenyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 425.957853761 u |
| Formula | C16H16Br2N2O2 |
| InChI | InChI=1S/C16H16Br2N2O2/c1-20(2)10-16(21)19-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-9H,10H2,1-2H3,(H,19,21) |
| InChIKey | KZQZFOFYKMSENU-UHFFFAOYSA-N |
| Molecular Weight | 428.124 g/mol |
| SMILES | N(C(=O)CN(C)C)c1ccc(Oc2c(cc(cc2)Br)Br)cc1 |