SpectraBase Spectrum ID |
7Kg8yljElHK |
Name |
Terephthalic acid, 3,4-difluorobenzyl nonyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
418.195565704 u |
Formula |
C24H28F2O4 |
InChI |
InChI=1S/C24H28F2O4/c1-2-3-4-5-6-7-8-15-29-23(27)19-10-12-20(13-11-19)24(28)30-17-18-9-14-21(25)22(26)16-18/h9-14,16H,2-8,15,17H2,1H3 |
InChIKey |
LZIADGCCFRIFIJ-UHFFFAOYSA-N |
Molecular Weight |
418.481 g/mol |
SMILES |
C1=CC(=CC=C1C(OCC1=CC=C(C(=C1)F)F)=O)C(OCCCCCCCCC)=O |