SpectraBase Spectrum ID |
FBJ3EF9kfyd |
Name |
3-[N-[2-Diethylaminoethyl]-1-cyclopentenylamino]propionitrile |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
235.204847817 u |
Formula |
C14H25N3 |
InChI |
InChI=1S/C14H25N3/c1-3-16(4-2)12-13-17(11-7-10-15)14-8-5-6-9-14/h8H,3-7,9,11-13H2,1-2H3 |
InChIKey |
ANMVAIQEPXQGFB-UHFFFAOYSA-N |
Molecular Weight |
235.375 g/mol |
SMILES |
CCN(CC)CCN(CCC#N)C1=CCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.89656 |