| SpectraBase Spectrum ID |
DjmnydASpSC |
| Name |
3-Bromo-4-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/c8-5-3-4(7(10)11)1-2-6(5)9/h1-3H,(H,10,11) |
| InChIKey |
ONELILMJNOWXSA-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
219.009 g/mol |
| Nominal Mass |
218 u |
| Quality |
922 |
| Retention Index |
1529 |
| SMILES |
OC(C=1C=C(C(=CC1)F)Br)=O |
| SPLASH |
splash10-0g4l-9260000000-918faa557d373520ed05 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3-bromo-4-fluorobenzoic acid |
| Technique |
GC/MS |
| Wiley ID |
DD2024_004962 |
