| SpectraBase Spectrum ID |
ATiyOf01bIo |
| Name |
2,6-Pyridinedicarboxylic acid, dodecyl 2-pentyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
405.287908736 u |
| Formula |
C24H39NO4 |
| InChI |
InChI=1S/C24H39NO4/c1-4-6-7-8-9-10-11-12-13-14-19-28-23(26)21-17-15-18-22(25-21)24(27)29-20(3)16-5-2/h15,17-18,20H,4-14,16,19H2,1-3H3 |
| InChIKey |
CINJKEWJAYAEMQ-UHFFFAOYSA-N |
| Molecular Weight |
405.579 g/mol |
| SMILES |
CC(OC(C1=NC(C(OCCCCCCCCCCCC)=O)=CC=C1)=O)CCC |
