| SpectraBase Spectrum ID |
7qji8dSfD3V |
| Name |
Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl 2,2,3,3-tetrafluoropropyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
460.054396818 u |
| Formula |
C13H12F12O4 |
| InChI |
InChI=1S/C13H12F12O4/c14-8(15)10(18,19)4-28-6(26)2-1-3-7(27)29-5-11(20,21)13(24,25)12(22,23)9(16)17/h8-9H,1-5H2 |
| InChIKey |
ASXLPRQPSLOJCF-UHFFFAOYSA-N |
| Molecular Weight |
460.216 g/mol |
| SMILES |
C(CCC(OCC(C(C(C(F)F)(F)F)(F)F)(F)F)=O)C(OCC(C(F)F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.838242 |
