| SpectraBase Spectrum ID |
2mg9sU0TFD |
| Name |
2,6-Pyridinedicarboxylic acid, 2,4,5-trifluorobenzyl hexyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H20F3NO4 |
| InChI |
InChI=1S/C20H20F3NO4/c1-2-3-4-5-9-27-19(25)17-7-6-8-18(24-17)20(26)28-12-13-10-15(22)16(23)11-14(13)21/h6-8,10-11H,2-5,9,12H2,1H3 |
| InChIKey |
BGRRHKJGLGJFMZ-UHFFFAOYSA-N |
| Molecular Weight |
395.378 g/mol |
| SMILES |
C(OC(c1nc(ccc1)C(OCc1c(cc(c(c1)F)F)F)=O)=O)CCCCC |
| SPLASH |
splash10-05fs-2900000000-7ff7f81386cbb2895452 |
| Source of Spectrum |
TIPS-2023-907-0 |
| Wiley ID |
1885613 |
