| SpectraBase Spectrum ID |
3McuO7GVTqi |
| Name |
Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl 3-methylbut-3-en-1-yl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
414.107734360 u |
| Formula |
C15H18F8O4 |
| InChI |
InChI=1S/C15H18F8O4/c1-9(2)6-7-26-10(24)4-3-5-11(25)27-8-13(18,19)15(22,23)14(20,21)12(16)17/h12H,1,3-8H2,2H3 |
| InChIKey |
UJLLPNIQBRGAEL-UHFFFAOYSA-N |
| Molecular Weight |
414.292 g/mol |
| SMILES |
C(CCC(OCC(C(C(C(F)F)(F)F)(F)F)(F)F)=O)C(OCCC(C)=C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.881113 |
