SpectraBase Compound ID | HCPUrfOlYi1 |
---|---|
InChI | InChI=1S/C7H4BrFO/c8-6-1-2-7(9)5(3-6)4-10/h1-4H |
InChIKey | MMFGGDVQLQQQRX-UHFFFAOYSA-N |
Mol Weight | 203.01 g/mol |
Molecular Formula | C7H4BrFO |
Exact Mass | 201.942956 g/mol |
SpectraBase Spectrum ID | HKril6eEDgw |
---|---|
Name | 2-Fluoro-5-bromo-benzaldehyde |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 201.942955911 u |
Formula | C7H4BrFO |
InChI | InChI=1S/C7H4BrFO/c8-6-1-2-7(9)5(3-6)4-10/h1-4H |
InChIKey | MMFGGDVQLQQQRX-UHFFFAOYSA-N |
Molecular Weight | 203.010 g/mol |
SMILES | C=1(Br)C=CC(=C(C=O)C1)F |
Spectrum/Structure Validation Score (Raman) | 0.705784 |