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N-{4-[(4-benzyl-1-piperazinyl)carbonyl]-1-phenyl-1H-pyrazol-5-yl}-4-bromobenzamide
SpectraBase Compound ID 7SK4nRcM2e7
InChI InChI=1S/C28H26BrN5O2/c29-23-13-11-22(12-14-23)27(35)31-26-25(19-30-34(26)24-9-5-2-6-10-24)28(36)33-17-15-32(16-18-33)20-21-7-3-1-4-8-21/h1-14,19H,15-18,20H2,(H,31,35)
InChIKey RKGSQTIPUGBNFQ-UHFFFAOYSA-N
Mol Weight 544.45 g/mol
Molecular Formula C28H26BrN5O2
Exact Mass 543.126988 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID In8JnIy3cBD
Name N-{4-[(4-benzyl-1-piperazinyl)carbonyl]-1-phenyl-1H-pyrazol-5-yl}-4-bromobenzamide
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/C28H26BrN5O2/c29-23-13-11-22(12-14-23)27(35)31-26-25(19-30-34(26)24-9-5-2-6-10-24)28(36)33-17-15-32(16-18-33)20-21-7-3-1-4-8-21/h1-14,19H,15-18,20H2,(H,31,35)
InChIKey RKGSQTIPUGBNFQ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1009
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: /VSVE61130; UBI_ID: UBI-001010
Temperature 318 °C