SpectraBase Spectrum ID |
BrkctVbxBV6 |
Name |
1-[2-(2,4-Dichlorophenoxy)propanoyl]-4-(4-fluorophenyl)piperazine |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
396.080761421 u |
Formula |
C19H19Cl2FN2O2 |
InChI |
InChI=1S/C19H19Cl2FN2O2/c1-13(26-18-7-2-14(20)12-17(18)21)19(25)24-10-8-23(9-11-24)16-5-3-15(22)4-6-16/h2-7,12-13H,8-11H2,1H3 |
InChIKey |
VYZSSZOGROBGKG-UHFFFAOYSA-N |
Molecular Weight |
397.277 g/mol |
SMILES |
CC(OC=1C(=CC(=CC1)Cl)Cl)C(=O)N1CCN(C2=CC=C(C=C2)F)CC1 |