SpectraBase Spectrum ID |
JJ3ZOOwHyJz |
Name |
Cyclohexanecarboxamide, N-(2-pentyl)-N-ethyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
225.209264492 u |
Formula |
C14H27NO |
InChI |
InChI=1S/C14H27NO/c1-4-9-12(3)15(5-2)14(16)13-10-7-6-8-11-13/h12-13H,4-11H2,1-3H3 |
InChIKey |
QXTXXPHVMOQPNB-UHFFFAOYSA-N |
Molecular Weight |
225.376 g/mol |
SMILES |
C(N(C(CCC)C)C(C1CCCCC1)=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.925218 |