SpectraBase Spectrum ID |
FJ2OJNiRGHe |
Name |
p-(3,5-Dimethylpiperidino)benzonitrile |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
214.146998588 u |
Formula |
C14H18N2 |
InChI |
InChI=1S/C14H18N2/c1-11-7-12(2)10-16(9-11)14-5-3-13(8-15)4-6-14/h3-6,11-12H,7,9-10H2,1-2H3 |
InChIKey |
MFOPNLIVQPGAAB-UHFFFAOYSA-N |
Molecular Weight |
214.312 g/mol |
SMILES |
C1C(CN(CC1C)C=1C=CC(=CC1)C#N)C |
Spectrum/Structure Validation Score (Raman) |
0.883084 |