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N-[4-(4-butyryl-1-piperazinyl)-3-chlorophenyl]-N'-(4-fluorobenzoyl)thiourea
SpectraBase Compound ID 64iC06MThTj
InChI InChI=1S/C22H24ClFN4O2S/c1-2-3-20(29)28-12-10-27(11-13-28)19-9-8-17(14-18(19)23)25-22(31)26-21(30)15-4-6-16(24)7-5-15/h4-9,14H,2-3,10-13H2,1H3,(H2,25,26,30,31)
InChIKey GPNQUMHPEQDVKO-UHFFFAOYSA-N
Mol Weight 462.97 g/mol
Molecular Formula C22H24ClFN4O2S
Exact Mass 462.129253 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G3qpuW7narQ
Name N-[4-(4-butyryl-1-piperazinyl)-3-chlorophenyl]-N'-(4-fluorobenzoyl)thiourea
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/C22H24ClFN4O2S/c1-2-3-20(29)28-12-10-27(11-13-28)19-9-8-17(14-18(19)23)25-22(31)26-21(30)15-4-6-16(24)7-5-15/h4-9,14H,2-3,10-13H2,1H3,(H2,25,26,30,31)
InChIKey GPNQUMHPEQDVKO-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_18524
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: D32855; Labnumber: SPMOS1-37160; SBI_ID: SBI-018527
Temperature 306 °C