| SpectraBase Spectrum ID |
33ccTprnRkw |
| Name |
Glutaric acid, 2,2,3,3-tetrafluoropropyl 3-fluorophenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
340.073399710 u |
| Formula |
C14H13F5O4 |
| InChI |
InChI=1S/C14H13F5O4/c15-9-3-1-4-10(7-9)23-12(21)6-2-5-11(20)22-8-14(18,19)13(16)17/h1,3-4,7,13H,2,5-6,8H2 |
| InChIKey |
RMBNSIFXQVIZAD-UHFFFAOYSA-N |
| Molecular Weight |
340.246 g/mol |
| SMILES |
C(CCC(OCC(C(F)F)(F)F)=O)C(OC1=CC=CC(=C1)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.826803 |
