SpectraBase Spectrum ID |
Jcdb4gd3dgS |
Name |
N-Cyclohexyl-N'-cyclooctylurea |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
252.220163529 u |
Formula |
C15H28N2O |
InChI |
InChI=1S/C15H28N2O/c18-15(17-14-11-7-4-8-12-14)16-13-9-5-2-1-3-6-10-13/h13-14H,1-12H2,(H2,16,17,18) |
InChIKey |
LITYOAMZVKPAFJ-UHFFFAOYSA-N |
Molecular Weight |
252.402 g/mol |
SMILES |
C1(NC(=O)NC2CCCCCCC2)CCCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.920389 |