SpectraBase Spectrum ID |
6QLq4ouwkED |
Name |
8,11-Dimethyltetradecanoic acid, picolinyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
347.282429433 u |
Formula |
C22H37NO2 |
InChI |
InChI=1S/C22H37NO2/c1-4-10-19(2)14-15-20(3)11-7-5-6-8-13-22(24)25-18-21-12-9-16-23-17-21/h9,12,16-17,19-20H,4-8,10-11,13-15,18H2,1-3H3 |
InChIKey |
SYXBIARQCKLPQX-UHFFFAOYSA-N |
Molecular Weight |
347.543 g/mol |
SMILES |
C1(=CN=CC=C1)COC(CCCCCCC(CCC(CCC)C)C)=O |