SpectraBase Spectrum ID |
FE3fbEaC24c |
Name |
Pipradol HC l inkbr |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
321.149556715 u |
Formula |
C18H24ClNO2 |
InChI |
InChI=1S/C18H21NO.ClH.H2O/c20-18(15-9-3-1-4-10-15,16-11-5-2-6-12-16)17-13-7-8-14-19-17;;/h1-6,9-12,17,19-20H,7-8,13-14H2;1H;1H2 |
InChIKey |
XQSMUOVQUGHUCC-UHFFFAOYSA-N |
Molecular Weight |
321.848 g/mol |
SMILES |
OC(C=1C=CC=CC1)(C=1C=CC=CC1)C1CCCCN1.O.Cl |
Spectrum/Structure Validation Score (Raman) |
0.997069 |