SpectraBase Spectrum ID |
76x0h7upIfX |
Name |
Glycine, N-methyl-N-ethoxycarbonyl-, octadecyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
413.350508993 u |
Formula |
C24H47NO4 |
InChI |
InChI=1S/C24H47NO4/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-29-23(26)22-25(3)24(27)28-5-2/h4-22H2,1-3H3 |
InChIKey |
FUWCMQUPTHJGKS-UHFFFAOYSA-N |
Molecular Weight |
413.643 g/mol |
SMILES |
CCOC(N(CC(OCCCCCCCCCCCCCCCCCC)=O)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.838226 |