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1-{2-[(o-chlorophenyl)phenylmethoxy]ethyl}-4-cyclohexylpiperazine, dihydrochloride
SpectraBase Compound ID 4g7t52KqPNi
InChI InChI=1S/C25H33ClN2O.2ClH/c26-24-14-8-7-13-23(24)25(21-9-3-1-4-10-21)29-20-19-27-15-17-28(18-16-27)22-11-5-2-6-12-22;;/h1,3-4,7-10,13-14,22,25H,2,5-6,11-12,15-20H2;2*1H
InChIKey NSQLSPIGRHGWCV-UHFFFAOYSA-N
Mol Weight 485.9 g/mol
Molecular Formula C25H35Cl3N2O
Exact Mass 484.181497 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IVvNVAu3hfs
Name 1-{2-[(o-CHLOROPHENYL)PHENYLMETHOXY]ETHYL}-4-CYCLOHEXYLPIPERAZINE,DIHYDROCHLORIDE
Source of Sample H. Morren, Union Chimique Belge, Brussels, Belgium
Boiling Point 235-240C/0.05mm
Comments Some carbon atoms are unassigned
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H33ClN2O 2HCl
InChI InChI=1S/C25H33ClN2O.2ClH/c26-24-14-8-7-13-23(24)25(21-9-3-1-4-10-21)29-20-19-27-15-17-28(18-16-27)22-11-5-2-6-12-22;;/h1,3-4,7-10,13-14,22,25H,2,5-6,11-12,15-20H2;2*1H
InChIKey NSQLSPIGRHGWCV-UHFFFAOYSA-N
Melting Point 233C
Molecular Weight 485.93
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms PIPERAZINE, 1-/2-/2-CHLOROBENZHYDRYLOXY/ETHYL/-4-CYCLOHEXYL-, DIHYDROCHLORIDE