| SpectraBase Spectrum ID |
KPBA5EhfaY9 |
| Name |
Methyl 2-hydroxy-3-octyl-4-(2'-furyl)-6-(trifluoromethyl)-benzoate |
| Alternate Name(s) |
Methyl 4-(furan-2-yl)-2-hydroxy-3-octyl-6-(trifluoromethyl)benzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H25F3O4 |
| InChI |
InChI=1S/C21H25F3O4/c1-3-4-5-6-7-8-10-14-15(17-11-9-12-28-17)13-16(21(22,23)24)18(19(14)25)20(26)27-2/h9,11-13,25H,3-8,10H2,1-2H3 |
| InChIKey |
TXBIJRGPNWWDKO-UHFFFAOYSA-N |
| Molecular Weight |
398.422 g/mol |
| SMILES |
Oc1c(c(C(F)(F)F)cc(c1CCCCCCCC)-c1occc1)C(=O)OC |
| SPLASH |
splash10-014j-0159000000-aa9925b9ac60b73338d2 |
| Source of Spectrum |
F5-6-3551-10j |
| Wiley ID |
1733631 |
