SpectraBase Spectrum ID |
IjINeo1Frr0 |
Name |
Picolinyl 16-methyl-nonadecanoate |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
403.345029691 u |
Formula |
C26H45NO2 |
InChI |
InChI=1S/C26H45NO2/c1-3-17-24(2)18-14-12-10-8-6-4-5-7-9-11-13-15-20-26(28)29-23-25-19-16-21-27-22-25/h16,19,21-22,24H,3-15,17-18,20,23H2,1-2H3 |
InChIKey |
UQSJJHAUZSNWAF-UHFFFAOYSA-N |
Molecular Weight |
403.651 g/mol |
SMILES |
C1=CN=CC(=C1)COC(CCCCCCCCCCCCCCC(CCC)C)=O |