SpectraBase Spectrum ID |
9ieiRgESMH |
Name |
Glutaric acid, monoamide, N-dodecyl-, pentyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
369.324294246 u |
Formula |
C22H43NO3 |
InChI |
InChI=1S/C22H43NO3/c1-3-5-7-8-9-10-11-12-13-14-19-23-21(24)17-16-18-22(25)26-20-15-6-4-2/h3-20H2,1-2H3,(H,23,24) |
InChIKey |
RFBOEUXUCFUUGJ-UHFFFAOYSA-N |
Molecular Weight |
369.590 g/mol |
SMILES |
CCCCCOC(CCCC(NCCCCCCCCCCCC)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.957552 |