2-Chloro-5-fluoro-4-[4-(4-fluoro-benzoyl)-piperazin-1-yl]-benzonitrile

SpectraBase Compound ID	5VRaiWKjper
InChI	InChI=1S/C18H14ClF2N3O/c19-15-10-17(16(21)9-13(15)11-22)23-5-7-24(8-6-23)18(25)12-1-3-14(20)4-2-12/h1-4,9-10H,5-8H2
InChIKey	DULJRUMFTKLVEA-UHFFFAOYSA-N Google Search
Mol Weight	361.78 g/mol
Molecular Formula	C18H14ClF2N3O
Exact Mass	361.079346 g/mol

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SpectraBase Spectrum ID	FyZw04W61F9
Name	2-chloro-5-fluoro-4-[4-(4-fluorobenzoyl)-1-piperazinyl]benzonitrile
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/C18H14ClF2N3O/c19-15-10-17(16(21)9-13(15)11-22)23-5-7-24(8-6-23)18(25)12-1-3-14(20)4-2-12/h1-4,9-10H,5-8H2
InChIKey	DULJRUMFTKLVEA-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7000_5228
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: NMR/11211168; Labnumber: LIP-0001661; IOH_ID: IOH-005229