| SpectraBase Spectrum ID |
4Tu7wlZXcBH |
| Name |
1,2-Cyclohexanedicarboxylic acid, 2-fluorophenyl hexyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
350.189337508 u |
| Formula |
C20H27FO4 |
| InChI |
InChI=1S/C20H27FO4/c1-2-3-4-9-14-24-19(22)15-10-5-6-11-16(15)20(23)25-18-13-8-7-12-17(18)21/h7-8,12-13,15-16H,2-6,9-11,14H2,1H3 |
| InChIKey |
RMTXPYILJQATQJ-UHFFFAOYSA-N |
| Molecular Weight |
350.430 g/mol |
| SMILES |
C1=C(C(=CC=C1)F)OC(C1CCCCC1C(OCCCCCC)=O)=O |
