| SpectraBase Spectrum ID |
3VsQZlY3c5H |
| Name |
2,6-Pyridinedicarboxylic acid, hexadecyl 2-methylpentyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
475.366159058 u |
| Formula |
C29H49NO4 |
| InChI |
InChI=1S/C29H49NO4/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-23-33-28(31)26-21-19-22-27(30-26)29(32)34-24-25(3)20-5-2/h19,21-22,25H,4-18,20,23-24H2,1-3H3 |
| InChIKey |
KPYXWJXJJGJPGM-UHFFFAOYSA-N |
| Molecular Weight |
475.714 g/mol |
| SMILES |
CCCCCCCCCCCCCCCCOC(C=1N=C(C(OCC(CCC)C)=O)C=CC1)=O |
