| SpectraBase Compound ID | BTyDCn5umAK |
|---|---|
| InChI | InChI=1S/C11H6Br2O3/c1-4-2-7(14)9-8(10(4)15)5(12)3-6(13)11(9)16/h2-3,16H,1H3 |
| InChIKey | UXJFMZJTGNENLF-UHFFFAOYSA-N |
| Mol Weight | 345.97 g/mol |
| Molecular Formula | C11H6Br2O3 |
| Exact Mass | 343.86837 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 | 49Yc1SaEf5U |
|---|---|
| Name | 6,8-Dibromoplumbagin |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 343.868370050 u |
| Formula | C11H6Br2O3 |
| InChI | InChI=1S/C11H6Br2O3/c1-4-2-7(14)9-8(10(4)15)5(12)3-6(13)11(9)16/h2-3,16H,1H3 |
| InChIKey | UXJFMZJTGNENLF-UHFFFAOYSA-N |
| Molecular Weight | 345.974 g/mol |
| SMILES | C=1C(Br)=C2C(C(=CC(C2=C(O)C1Br)=O)C)=O |