SpectraBase Spectrum ID |
HWhTkmwOemW |
Name |
Ethyl 2,3,3,3-tetrafluoro-2-(heptafluoropropoxy)propanoate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
358.006303811 u |
Formula |
C8H5F11O3 |
InChI |
InChI=1S/C8H5F11O3/c1-2-21-3(20)4(9,6(12,13)14)22-8(18,19)5(10,11)7(15,16)17/h2H2,1H3 |
InChIKey |
HJLWKGDZOZTKIS-UHFFFAOYSA-N |
Molecular Weight |
358.107 g/mol |
SMILES |
C(OCC)(=O)C(C(F)(F)F)(F)OC(C(C(F)(F)F)(F)F)(F)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.873062 |