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piperazine, 1-(3-bromobenzoyl)-4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]-
SpectraBase Compound ID 2pcN37zlxg2
InChI InChI=1S/C22H22BrN5O3/c1-15-12-16(2)27(24-15)21-14-19(6-7-20(21)28(30)31)25-8-10-26(11-9-25)22(29)17-4-3-5-18(23)13-17/h3-7,12-14H,8-11H2,1-2H3
InChIKey XKJUEJLUOUOXBT-UHFFFAOYSA-N
Mol Weight 484.35 g/mol
Molecular Formula C22H22BrN5O3
Exact Mass 483.090603 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7sSCpiZ2K3a
Name piperazine, 1-(3-bromobenzoyl)-4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 483.090602585 u
Formula C22H22BrN5O3
InChI InChI=1S/C22H22BrN5O3/c1-15-12-16(2)27(24-15)21-14-19(6-7-20(21)28(30)31)25-8-10-26(11-9-25)22(29)17-4-3-5-18(23)13-17/h3-7,12-14H,8-11H2,1-2H3
InChIKey XKJUEJLUOUOXBT-UHFFFAOYSA-N
Molecular Weight 484.354 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16297
Solvent DMSO-d6
Source Vendor ID: NMR/11211700; Lab Info: LP; Lab Number: LP-2501653