| SpectraBase Compound ID | CpDMJtz4hGi |
|---|---|
| InChI | InChI=1S/C7H3Br5O/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h1H3 |
| InChIKey | VEFNQGLEDJPUJF-UHFFFAOYSA-N |
| Mol Weight | 502.62 g/mol |
| Molecular Formula | C7H3Br5O |
| Exact Mass | 497.61008 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BXKJv4yxr7s |
|---|---|
| Name | Benzene, pentabromomethoxy- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 497.610079716 u |
| Formula | C7H3Br5O |
| InChI | InChI=1S/C7H3Br5O/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h1H3 |
| InChIKey | VEFNQGLEDJPUJF-UHFFFAOYSA-N |
| Molecular Weight | 502.620 g/mol |
| SMILES | C=1(C(=C(Br)C(=C(C1Br)OC)Br)Br)Br |