SpectraBase Spectrum ID |
K2Pw1DkMY6J |
Name |
Glycine, N-ethoxycarbonyl-, heptadecyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
385.319208865 u |
Formula |
C22H43NO4 |
InChI |
InChI=1S/C22H43NO4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-27-21(24)20-23-22(25)26-4-2/h3-20H2,1-2H3,(H,23,25) |
InChIKey |
YENBERSCJZJODC-UHFFFAOYSA-N |
Molecular Weight |
385.589 g/mol |
SMILES |
CCOC(NCC(OCCCCCCCCCCCCCCCCC)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.825818 |