SpectraBase Spectrum ID |
EvYh6LrD8QP |
Name |
[(1-Chloro-2-naphthyl)oxy]acetic acid, 2-(diethylamino)ethyl ester, hydrochloride |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
371.105499002 u |
Formula |
C18H23Cl2NO3 |
InChI |
InChI=1S/C18H22ClNO3.ClH/c1-3-20(4-2)11-12-22-17(21)13-23-16-10-9-14-7-5-6-8-15(14)18(16)19;/h5-10H,3-4,11-13H2,1-2H3;1H |
InChIKey |
BOPGVIJKSPRZHU-UHFFFAOYSA-N |
Molecular Weight |
372.292 g/mol |
SMILES |
C1=CC=CC2=C1C(Cl)=C(C=C2)OCC(=O)OCCN(CC)CC.Cl |
Spectrum/Structure Validation Score (Raman) |
0.896655 |