SpectraBase Spectrum ID |
9as3GM6Gx8i |
Name |
Cyclohexanecarboxamide, N-(2-pentyl)-N-octyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
309.303164879 u |
Formula |
C20H39NO |
InChI |
InChI=1S/C20H39NO/c1-4-6-7-8-9-13-17-21(18(3)14-5-2)20(22)19-15-11-10-12-16-19/h18-19H,4-17H2,1-3H3 |
InChIKey |
IXPYMELOVAXRTD-UHFFFAOYSA-N |
Molecular Weight |
309.538 g/mol |
SMILES |
C(N(C(CCC)C)C(C1CCCCC1)=O)CCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.901583 |