| SpectraBase Spectrum ID |
5XrRzgNAENM |
| Name |
1,1'-Binaphthalene, 3,3'-dibromo-2,2'-dimethoxy-, (+/-)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
469.951705753 u |
| Formula |
C22H16Br2O2 |
| InChI |
InChI=1S/C22H16Br2O2/c1-25-21-17(23)11-13-7-3-5-9-15(13)19(21)20-16-10-6-4-8-14(16)12-18(24)22(20)26-2/h3-12H,1-2H3 |
| InChIKey |
DFTUKDIMHCCQIT-UHFFFAOYSA-N |
| Molecular Weight |
472.176 g/mol |
| SMILES |
C1=C(C(=C(C=2C=CC=CC12)C1=C(C(=CC=2C=CC=CC12)Br)OC)OC)Br |
| Spectrum/Structure Validation Score (Raman) |
0.960543 |
