SpectraBase Spectrum ID |
4jD65xALLLB |
Name |
N-(2-oxo-1-Pentylazepan-3-yl)cyclohexanecarboxamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
308.246378276 u |
Formula |
C18H32N2O2 |
InChI |
InChI=1S/C18H32N2O2/c1-2-3-8-13-20-14-9-7-12-16(18(20)22)19-17(21)15-10-5-4-6-11-15/h15-16H,2-14H2,1H3,(H,19,21) |
InChIKey |
BWCUVDKSAUYMQE-UHFFFAOYSA-N |
SMILES |
C1(CCCCC1)C(=O)NC1C(N(CCCC1)CCCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.90433 |