SpectraBase Spectrum ID |
9R95o1xIZE9 |
Name |
Cyclohexanecarboxamide, N-octadecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
379.381415201 u |
Formula |
C25H49NO |
InChI |
InChI=1S/C25H49NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-26-25(27)24-21-18-17-19-22-24/h24H,2-23H2,1H3,(H,26,27) |
InChIKey |
UOJWCKBTLPPNFI-UHFFFAOYSA-N |
Molecular Weight |
379.673 g/mol |
SMILES |
C1C(CCCC1)C(NCCCCCCCCCCCCCCCCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.915954 |