SpectraBase Spectrum ID |
7NFu63RvfeY |
Name |
2,6-Pyridinedicarboxylic acid, decyl 5-methoxy-3-methylpent-2-yl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
421.282823355 u |
Formula |
C24H39NO5 |
InChI |
InChI=1S/C24H39NO5/c1-5-6-7-8-9-10-11-12-17-29-23(26)21-14-13-15-22(25-21)24(27)30-20(3)19(2)16-18-28-4/h13-15,19-20H,5-12,16-18H2,1-4H3 |
InChIKey |
DGTSCPJWUDHJRA-UHFFFAOYSA-N |
Molecular Weight |
421.578 g/mol |
SMILES |
CC(OC(C1=NC(C(OCCCCCCCCCC)=O)=CC=C1)=O)C(CCOC)C |