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1-benzhydryl-4-{[4-chloro-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}piperazine
SpectraBase Compound ID 5sDg4IpOQHO
InChI InChI=1S/C24H24ClF3N4O/c1-17-21(25)23(24(26,27)28)29-32(17)16-20(33)30-12-14-31(15-13-30)22(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,22H,12-16H2,1H3
InChIKey DGKLYFVDIYJAGU-UHFFFAOYSA-N
Mol Weight 476.93 g/mol
Molecular Formula C24H24ClF3N4O
Exact Mass 476.159074 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DKjZun9Adg3
Name 1-benzhydryl-4-{[4-chloro-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}piperazine
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/C24H24ClF3N4O/c1-17-21(25)23(24(26,27)28)29-32(17)16-20(33)30-12-14-31(15-13-30)22(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,22H,12-16H2,1H3
InChIKey DGKLYFVDIYJAGU-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_11747
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/9099622; UBI_ID: UBI-011750
Temperature 308 °C