| SpectraBase Compound ID | 9P9rFV2S2Qn |
|---|---|
| InChI | InChI=1S/C6H2BrCl3/c7-6-4(9)1-3(8)2-5(6)10/h1-2H |
| InChIKey | BAPPAFMEUDJAQI-UHFFFAOYSA-N |
| Mol Weight | 260.34 g/mol |
| Molecular Formula | C6H2BrCl3 |
| Exact Mass | 257.840546 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 3YMVzNkJh2K |
|---|---|
| Name | 1-Bromo-2,4,6-trichlorobenzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 257.840546164 u |
| Formula | C6H2BrCl3 |
| InChI | InChI=1S/C6H2BrCl3/c7-6-4(9)1-3(8)2-5(6)10/h1-2H |
| InChIKey | BAPPAFMEUDJAQI-UHFFFAOYSA-N |
| Molecular Weight | 260.345 g/mol |
| SMILES | C1=C(C(=C(C=C1Cl)Cl)Br)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.947752 |