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N-[1-(4-chlorobenzyl)-1H-pyrazol-3-yl]-N'-[1-(4-fluorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]thiourea
SpectraBase Compound ID DAWdFalPDMn
InChI InChI=1S/C23H22ClFN6S/c1-15-22(16(2)31(28-15)14-18-5-9-20(25)10-6-18)27-23(32)26-21-11-12-30(29-21)13-17-3-7-19(24)8-4-17/h3-12H,13-14H2,1-2H3,(H2,26,27,29,32)
InChIKey FGJWMAFKUDMAAG-UHFFFAOYSA-N
Mol Weight 468.98 g/mol
Molecular Formula C23H22ClFN6S
Exact Mass 468.129922 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IlvUfphFufr
Name N-[1-(4-chlorobenzyl)-1H-pyrazol-3-yl]-N'-[1-(4-fluorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]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/C23H22ClFN6S/c1-15-22(16(2)31(28-15)14-18-5-9-20(25)10-6-18)27-23(32)26-21-11-12-30(29-21)13-17-3-7-19(24)8-4-17/h3-12H,13-14H2,1-2H3,(H2,26,27,29,32)
InChIKey FGJWMAFKUDMAAG-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_8177
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/1268251; Labnumber: COL7004; UZI_ID: UZI-008179
Temperature 318 °C