| SpectraBase Spectrum ID |
51ckhXfChs0 |
| Name |
Benzofuran, 2-bromo-3,5-dichloro-2,3-dihydro-, trans- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
265.890083180 u |
| Formula |
C8H5BrCl2O |
| InChI |
InChI=1S/C8H5BrCl2O/c9-8-7(11)5-3-4(10)1-2-6(5)12-8/h1-3,7-8H/t7-,8-/m0/s1 |
| InChIKey |
UMTBVSIURBKIFY-YUMQZZPRSA-N |
| Molecular Weight |
267.937 g/mol |
| SMILES |
C=12C(O[C@@]([C@]2(Cl)[H])(Br)[H])=CC=C(C1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936589 |
