| SpectraBase Spectrum ID |
FrBkgm3w0B5 |
| Name |
Glutaric acid, 2-fluorophenyl 2-bromo-4-fluorophenyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
397.996528221 u |
| Formula |
C17H13BrF2O4 |
| InChI |
InChI=1S/C17H13BrF2O4/c18-12-10-11(19)8-9-14(12)23-16(21)6-3-7-17(22)24-15-5-2-1-4-13(15)20/h1-2,4-5,8-10H,3,6-7H2 |
| InChIKey |
QQKFXUVHIHZLJG-UHFFFAOYSA-N |
| Molecular Weight |
399.188 g/mol |
| SMILES |
C(CCC(OC1=CC=CC=C1F)=O)C(OC=1C(=CC(=CC1)F)Br)=O |
