2-(3,4-dimethylphenyl)-4-{[4-(4-fluorophenyl)-1-piperazinyl]carbonyl}quinoline

SpectraBase Compound ID	LKAav3xAXwP
InChI	InChI=1S/C28H26FN3O/c1-19-7-8-21(17-20(19)2)27-18-25(24-5-3-4-6-26(24)30-27)28(33)32-15-13-31(14-16-32)23-11-9-22(29)10-12-23/h3-12,17-18H,13-16H2,1-2H3
InChIKey	AJMNBUAFERHSGH-UHFFFAOYSA-N Google Search
Mol Weight	439.53 g/mol
Molecular Formula	C28H26FN3O
Exact Mass	439.205991 g/mol

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SpectraBase Spectrum ID	KXPr18B3Dso
Name	2-(3,4-dimethylphenyl)-4-{[4-(4-fluorophenyl)-1-piperazinyl]carbonyl}quinoline
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C28H26FN3O/c1-19-7-8-21(17-20(19)2)27-18-25(24-5-3-4-6-26(24)30-27)28(33)32-15-13-31(14-16-32)23-11-9-22(29)10-12-23/h3-12,17-18H,13-16H2,1-2H3
InChIKey	AJMNBUAFERHSGH-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_6372
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: UZI/8182217; UBI_ID: UBI-006374
Temperature	318 °C