SpectraBase Spectrum ID |
9dOGRvGvf2D |
Name |
Terephthalic acid, dodecyl 2,2,3,4,4,4-hexafluorobutyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
498.220478484 u |
Formula |
C24H32F6O4 |
InChI |
InChI=1S/C24H32F6O4/c1-2-3-4-5-6-7-8-9-10-11-16-33-20(31)18-12-14-19(15-13-18)21(32)34-17-23(26,27)22(25)24(28,29)30/h12-15,22H,2-11,16-17H2,1H3/t22-/m0/s1 |
InChIKey |
PWOLXEJVGFVYJK-QFIPXVFZSA-N |
Molecular Weight |
498.506 g/mol |
SMILES |
C1(=CC=C(C=C1)C(OCCCCCCCCCCCC)=O)C(OCC([C@@](C(F)(F)F)(F)[H])(F)F)=O |