| SpectraBase Compound ID | IQ5Zv4aRF3N |
|---|---|
| InChI | InChI=1S/C20H16Br2/c21-19-11-5-3-9-17(19)13-15-7-1-2-8-16(15)14-18-10-4-6-12-20(18)22/h1-12H,13-14H2 |
| InChIKey | RAWXQIXQQFTPCZ-UHFFFAOYSA-N |
| Mol Weight | 416.16 g/mol |
| Molecular Formula | C20H16Br2 |
| Exact Mass | 413.961877 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5TAmdKK1zgl |
|---|---|
| Name | 1,2-bis(2-Bromobenzyl)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 413.961876515 u |
| Formula | C20H16Br2 |
| InChI | InChI=1S/C20H16Br2/c21-19-11-5-3-9-17(19)13-15-7-1-2-8-16(15)14-18-10-4-6-12-20(18)22/h1-12H,13-14H2 |
| InChIKey | RAWXQIXQQFTPCZ-UHFFFAOYSA-N |
| Molecular Weight | 416.156 g/mol |
| SMILES | C(C=1C(CC=2C(Br)=CC=CC2)=CC=CC1)C=1C(Br)=CC=CC1 |