| SpectraBase Compound ID | 8drqkjBeSCN |
|---|---|
| InChI | InChI=1S/C7HBrF4O/c8-3-6(11)4(9)2(1-13)5(10)7(3)12/h1H |
| InChIKey | ABQIERQXAUMNCS-UHFFFAOYSA-N |
| Mol Weight | 256.98 g/mol |
| Molecular Formula | C7HBrF4O |
| Exact Mass | 255.91469 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 | BQOtaNxzbcb |
|---|---|
| Name | 4-Bromo-2,3,5,6-tetrafluorobenzaldehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 255.914690303 u |
| Formula | C7HBrF4O |
| InChI | InChI=1S/C7HBrF4O/c8-3-6(11)4(9)2(1-13)5(10)7(3)12/h1H |
| InChIKey | ABQIERQXAUMNCS-UHFFFAOYSA-N |
| Molecular Weight | 256.982 g/mol |
| SMILES | C=1(C(=C(F)C(=C(C1F)F)Br)F)C=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.840417 |