SpectraBase Spectrum ID |
6hTwjt7axkJ |
Name |
Phthalic acid, decyl 1-(2,6-difluorophenyl)ethyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
446.226865832 u |
Formula |
C26H32F2O4 |
InChI |
InChI=1S/C26H32F2O4/c1-3-4-5-6-7-8-9-12-18-31-25(29)20-14-10-11-15-21(20)26(30)32-19(2)24-22(27)16-13-17-23(24)28/h10-11,13-17,19H,3-9,12,18H2,1-2H3 |
InChIKey |
RBPAGCOIWDPTKH-UHFFFAOYSA-N |
Molecular Weight |
446.535 g/mol |
SMILES |
C(C1=CC=CC=C1C(=O)OC(C)C1=C(C=CC=C1F)F)(OCCCCCCCCCC)=O |