SpectraBase Spectrum ID |
4YU132OPLrJ |
Name |
Loxapine HC l inkbr |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
363.090517643 u |
Formula |
C18H19Cl2N3O |
InChI |
InChI=1S/C18H18ClN3O.ClH/c1-21-8-10-22(11-9-21)18-14-12-13(19)6-7-16(14)23-17-5-3-2-4-15(17)20-18;/h2-7,12H,8-11H2,1H3;1H |
InChIKey |
JSXBVMKACNEMKY-UHFFFAOYSA-N |
Molecular Weight |
364.276 g/mol |
SMILES |
CN1CCN(C=2C3=C(OC=4C=CC=CC4N2)C=CC(=C3)Cl)CC1.Cl |
Spectrum/Structure Validation Score (Raman) |
0.925518 |