| SpectraBase Spectrum ID |
8MwwUdyz7Ty |
| Name |
2,6-Pyridinedicarboxylic acid, hexyl 3-(2-methoxyethyl)heptyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
407.267173290 u |
| Formula |
C23H37NO5 |
| InChI |
InChI=1S/C23H37NO5/c1-4-6-8-9-16-28-22(25)20-12-10-13-21(24-20)23(26)29-18-15-19(11-7-5-2)14-17-27-3/h10,12-13,19H,4-9,11,14-18H2,1-3H3 |
| InChIKey |
ZBFAWFQEZJNUAG-UHFFFAOYSA-N |
| Molecular Weight |
407.551 g/mol |
| SMILES |
COCCC(CCOC(C1=NC(C(OCCCCCC)=O)=CC=C1)=O)CCCC |
