| SpectraBase Spectrum ID |
I2SIcHsgKgd |
| Name |
2-Fluoro-3-trifluoromethylbenzoic acid, 5-tetradecyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
404.233842920 u |
| Formula |
C22H32F4O2 |
| InChI |
InChI=1S/C22H32F4O2/c1-3-5-7-8-9-10-11-14-17(13-6-4-2)28-21(27)18-15-12-16-19(20(18)23)22(24,25)26/h12,15-17H,3-11,13-14H2,1-2H3 |
| InChIKey |
ADEWQXYXVLVBSP-UHFFFAOYSA-N |
| Molecular Weight |
404.490 g/mol |
| SMILES |
C1(=C(C=CC=C1C(OC(CCCC)CCCCCCCCC)=O)C(F)(F)F)F |
