![3-Bromo-2,2'-dimethoxy-5,5'-dimethyl-[1,1'-biphenyl]](/api/spectrum/2DdjYQZVvlz/structure.png?h=300&w=458 "3-Bromo-2,2'-dimethoxy-5,5'-dimethyl-[1,1'-biphenyl]")
| SpectraBase Compound ID | GnJ7TZ5PEuS |
|---|---|
| InChI | InChI=1S/C16H17BrO2/c1-10-5-6-15(18-3)12(7-10)13-8-11(2)9-14(17)16(13)19-4/h5-9H,1-4H3 |
| InChIKey | QXVNYQZZCBLDFK-UHFFFAOYSA-N |
| Mol Weight | 321.21 g/mol |
| Molecular Formula | C16H17BrO2 |
| Exact Mass | 320.041193 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 | 2DdjYQZVvlz |
|---|---|
| Name | 3-Bromo-2,2'-dimethoxy-5,5'-dimethyl-[1,1'-biphenyl] |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 320.041192785 u |
| Formula | C16H17BrO2 |
| InChI | InChI=1S/C16H17BrO2/c1-10-5-6-15(18-3)12(7-10)13-8-11(2)9-14(17)16(13)19-4/h5-9H,1-4H3 |
| InChIKey | QXVNYQZZCBLDFK-UHFFFAOYSA-N |
| Molecular Weight | 321.214 g/mol |
| SMILES | C=1(C=2C(=CC=C(C2)C)OC)C(=C(Br)C=C(C1)C)OC |