SpectraBase Spectrum ID |
6c0C1PW5fzl |
Name |
5-Bromo-2-fluorobenzoic acid |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
217.937870530 u |
Formula |
C7H4BrFO2 |
InChI |
InChI=1S/C7H4BrFO2/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H,10,11) |
InChIKey |
MDAZJVAIZVUWDE-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
219.009 g/mol |
Nominal Mass |
218 u |
Quality |
990 |
Retention Index |
1446 |
SMILES |
OC(C1=C(C=CC=C1F)Br)=O |
SPLASH |
splash10-0g4i-6290000000-4015cb097983d77e21a0 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
2-bromo-6-fluorobenzoic acid |
Technique |
GC/MS |
Wiley ID |
DD2024_004829 |