| SpectraBase Compound ID | 6zUu91t4MGi |
|---|---|
| InChI | InChI=1S/C8H5BrClFO/c9-4-8(12)5-1-2-7(11)6(10)3-5/h1-3H,4H2 |
| InChIKey | JOCPGHGWUUBURW-UHFFFAOYSA-N |
| Mol Weight | 251.48 g/mol |
| Molecular Formula | C8H5BrClFO |
| Exact Mass | 249.919634 g/mol |
Raman Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | BJKs1senF1t |
|---|---|
| Name | 3-Chloro-4-fluorophenacyl bromide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 249.919633643 u |
| Formula | C8H5BrClFO |
| InChI | InChI=1S/C8H5BrClFO/c9-4-8(12)5-1-2-7(11)6(10)3-5/h1-3H,4H2 |
| InChIKey | JOCPGHGWUUBURW-UHFFFAOYSA-N |
| Molecular Weight | 251.482 g/mol |
| SMILES | C1=C(C(=CC(=C1)C(CBr)=O)Cl)F |
| Spectrum/Structure Validation Score (Raman) | 0.964024 |