SpectraBase Spectrum ID |
Lm3Jsa73Vyj |
Name |
4-Chloro-N-[2-(1-piperidinyl)ethyl]benzamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
266.118590939 u |
Formula |
C14H19ClN2O |
InChI |
InChI=1S/C14H19ClN2O/c15-13-6-4-12(5-7-13)14(18)16-8-11-17-9-2-1-3-10-17/h4-7H,1-3,8-11H2,(H,16,18) |
InChIKey |
HQBDFUGKTLJCSU-UHFFFAOYSA-N |
Molecular Weight |
266.772 g/mol |
SMILES |
C1(Cl)=CC=C(C=C1)C(=O)NCCN1CCCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.869876 |