SpectraBase Spectrum ID |
Azvk93dFwHY |
Name |
2,6-Pyridinedicarboxylic acid, 4-trifluoromethylbenzyl 4-methylpent-2-yl ester |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H22F3NO4 |
InChI |
InChI=1S/C21H22F3NO4/c1-13(2)11-14(3)29-20(27)18-6-4-5-17(25-18)19(26)28-12-15-7-9-16(10-8-15)21(22,23)24/h4-10,13-14H,11-12H2,1-3H3 |
InChIKey |
BJUAFRHGIRAEEE-UHFFFAOYSA-N |
Molecular Weight |
409.405 g/mol |
SMILES |
C(OC(c1nc(ccc1)C(OCc1ccc(cc1)C(F)(F)F)=O)=O)(C)CC(C)C |
SPLASH |
splash10-0a4i-6932000000-72729fcd0071da685531 |
Source of Spectrum |
TIPS-2023-985-0 |
Wiley ID |
1885691 |