SpectraBase Spectrum ID |
Kb7pmJZkWld |
Name |
N-{1-[(5,6,7,8-Tetrahydro-2-naphthoyl)methyl]-4-piperidyl}benzamide, monohydrochloride |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
412.191755880 u |
Formula |
C24H29ClN2O2 |
InChI |
InChI=1S/C24H28N2O2.ClH/c27-23(21-11-10-18-6-4-5-9-20(18)16-21)17-26-14-12-22(13-15-26)25-24(28)19-7-2-1-3-8-19;/h1-3,7-8,10-11,16,22H,4-6,9,12-15,17H2,(H,25,28);1H |
InChIKey |
IPKQBMTURZYVED-UHFFFAOYSA-N |
Molecular Weight |
412.961 g/mol |
SMILES |
Cl.N(C(C1=CC=CC=C1)=O)C1CCN(CC1)CC(C=1C=C2CCCCC2=CC1)=O |
Spectrum/Structure Validation Score (Raman) |
0.920648 |