SpectraBase Spectrum ID |
EcLXnqUEnbm |
Name |
(E)-N-(2-Phenylethenyl)-piperidine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
187.136099551 u |
Formula |
C13H17N |
InChI |
InChI=1S/C13H17N/c1-3-7-13(8-4-1)9-12-14-10-5-2-6-11-14/h1,3-4,7-9,12H,2,5-6,10-11H2/b12-9+ |
InChIKey |
PAFMWEOWHZKACA-FMIVXFBMSA-N |
Molecular Weight |
187.286 g/mol |
SMILES |
C1(\C=C\N2CCCCC2)=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.903058 |