SpectraBase Spectrum ID |
m0NknuT2Z0 |
Name |
pcp Pyrrolidine analog HC l inkbr |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
265.159727477 u |
Formula |
C16H24ClN |
InChI |
InChI=1S/C16H23N.ClH/c1-3-9-15(10-4-1)16(11-5-2-6-12-16)17-13-7-8-14-17;/h1,3-4,9-10H,2,5-8,11-14H2;1H |
InChIKey |
FEUATZUGYUSKIY-UHFFFAOYSA-N |
Molecular Weight |
265.828 g/mol |
SMILES |
C1=C(C2(CCCCC2)N2CCCC2)C=CC=C1.Cl |
Spectrum/Structure Validation Score (Raman) |
0.993946 |