| SpectraBase Spectrum ID |
KeV4PfLNbOp |
| Name |
1,2-Cyclohexanedicarboxylic acid, pentafluorobenzyl tetradecyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
548.292500611 u |
| Formula |
C29H41F5O4 |
| InChI |
InChI=1S/C29H41F5O4/c1-2-3-4-5-6-7-8-9-10-11-12-15-18-37-28(35)20-16-13-14-17-21(20)29(36)38-19-22-23(30)25(32)27(34)26(33)24(22)31/h20-21H,2-19H2,1H3 |
| InChIKey |
SNYIBGQVLPRLLZ-UHFFFAOYSA-N |
| Molecular Weight |
548.635 g/mol |
| SMILES |
C1(=C(C(=C(C(=C1F)F)F)F)COC(C1CCCCC1C(OCCCCCCCCCCCCCC)=O)=O)F |
