SpectraBase Spectrum ID |
6akIMw2yzGh |
Name |
3-[N-[2-Diethylaminoethyl]-1-cyclohexenylamino]propylnitrile |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
249.220497881 u |
Formula |
C15H27N3 |
InChI |
InChI=1S/C15H27N3/c1-3-17(4-2)13-14-18(12-8-11-16)15-9-6-5-7-10-15/h9H,3-8,10,12-14H2,1-2H3 |
InChIKey |
WIKZDYHBGNKDBM-UHFFFAOYSA-N |
Molecular Weight |
249.402 g/mol |
SMILES |
C(#N)CCN(CCN(CC)CC)C=1CCCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.902076 |