SpectraBase Spectrum ID |
Ak5egJQ5Ri0 |
Name |
Glutaric acid, monoamide, N-dodecyl-, propyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
341.292994117 u |
Formula |
C20H39NO3 |
InChI |
InChI=1S/C20H39NO3/c1-3-5-6-7-8-9-10-11-12-13-17-21-19(22)15-14-16-20(23)24-18-4-2/h3-18H2,1-2H3,(H,21,22) |
InChIKey |
AKTYSPUWGSROMT-UHFFFAOYSA-N |
Molecular Weight |
341.536 g/mol |
SMILES |
CCCOC(CCCC(NCCCCCCCCCCCC)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.949162 |