SpectraBase Spectrum ID |
HGU4OZCjdHZ |
Name |
4-(p-Chloro-alpha-propylbenzyl)morpholine, hydrochloride |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
289.100019699 u |
Formula |
C14H21Cl2NO |
InChI |
InChI=1S/C14H20ClNO.ClH/c1-2-3-14(16-8-10-17-11-9-16)12-4-6-13(15)7-5-12;/h4-7,14H,2-3,8-11H2,1H3;1H |
InChIKey |
SEUCFKDKFDESJG-UHFFFAOYSA-N |
Molecular Weight |
290.234 g/mol |
SMILES |
Cl.C1(Cl)=CC=C(C(CCC)N2CCOCC2)C=C1 |
Spectrum/Structure Validation Score (Raman) |
0.99434 |