SpectraBase Spectrum ID |
ITl18M9AIRN |
Name |
Glutaric acid, monoamide, N-tetradecyl-, ethyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
355.308644181 u |
Formula |
C21H41NO3 |
InChI |
InChI=1S/C21H41NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-19-22-20(23)17-16-18-21(24)25-4-2/h3-19H2,1-2H3,(H,22,23) |
InChIKey |
LRVVLXXFTZXZTN-UHFFFAOYSA-N |
Molecular Weight |
355.563 g/mol |
SMILES |
C(CCCCCCCCCNC(CCCC(OCC)=O)=O)CCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.871524 |