SpectraBase Spectrum ID |
GdY1aYMPzGN |
Name |
Carbamic acid, N-allyl-N-octadecyl-, hexyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
437.423280013 u |
Formula |
C28H55NO2 |
InChI |
InChI=1S/C28H55NO2/c1-4-7-9-11-12-13-14-15-16-17-18-19-20-21-22-23-26-29(25-6-3)28(30)31-27-24-10-8-5-2/h6H,3-5,7-27H2,1-2H3 |
InChIKey |
GWMNNAHDMPONRN-UHFFFAOYSA-N |
Molecular Weight |
437.753 g/mol |
SMILES |
C(N(CCCCCCCCCCCCCCCCCC)CC=C)(=O)OCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.923832 |