SpectraBase Spectrum ID |
IAZonxeo3EJ |
Name |
Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl non-5-yn-3-yl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
468.154684553 u |
Formula |
C19H24F8O4 |
InChI |
InChI=1S/C19H24F8O4/c1-3-5-6-7-9-13(4-2)31-15(29)11-8-10-14(28)30-12-17(22,23)19(26,27)18(24,25)16(20)21/h13,16H,3-5,8-12H2,1-2H3 |
InChIKey |
SHYKAIPCNOSAMT-UHFFFAOYSA-N |
Molecular Weight |
468.384 g/mol |
SMILES |
C(CCC(OCC(C(C(C(F)F)(F)F)(F)F)(F)F)=O)C(OC(CC)CC#CCCC)=O |