| SpectraBase Spectrum ID |
K98rtW27Ers |
| Name |
2,6-Pyridinedicarboxylic acid, dodecyl 3-methylpent-2-yl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
419.303558800 u |
| Formula |
C25H41NO4 |
| InChI |
InChI=1S/C25H41NO4/c1-5-7-8-9-10-11-12-13-14-15-19-29-24(27)22-17-16-18-23(26-22)25(28)30-21(4)20(3)6-2/h16-18,20-21H,5-15,19H2,1-4H3 |
| InChIKey |
CIEYJSSEORJDFT-UHFFFAOYSA-N |
| Molecular Weight |
419.606 g/mol |
| SMILES |
CC(OC(C1=NC(C(OCCCCCCCCCCCC)=O)=CC=C1)=O)C(CC)C |
