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1H-pyrazole, 3,5-bis(4-bromophenyl)-4,5-dihydro-1-[(4-methylphenyl)sulfonyl]-
SpectraBase Compound ID BMCe2Fu03nE
InChI InChI=1S/C22H18Br2N2O2S/c1-15-2-12-20(13-3-15)29(27,28)26-22(17-6-10-19(24)11-7-17)14-21(25-26)16-4-8-18(23)9-5-16/h2-13,22H,14H2,1H3
InChIKey WQQMIFPRPIEVJF-UHFFFAOYSA-N
Mol Weight 534.27 g/mol
Molecular Formula C22H18Br2N2O2S
Exact Mass 531.945575 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Jd2f51Mf4z1
Name 1H-pyrazole, 3,5-bis(4-bromophenyl)-4,5-dihydro-1-[(4-methylphenyl)sulfonyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 531.945575000 u
Formula C22H18Br2N2O2S
InChI InChI=1S/C22H18Br2N2O2S/c1-15-2-12-20(13-3-15)29(27,28)26-22(17-6-10-19(24)11-7-17)14-21(25-26)16-4-8-18(23)9-5-16/h2-13,22H,14H2,1H3
InChIKey WQQMIFPRPIEVJF-UHFFFAOYSA-N
Molecular Weight 534.266 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_2914
Solvent DMSO-d6
Source Vendor ID: NMR/9248807; Lab Info: *1052592*; Lab Number: *1052592*
Temperature 29.85 °C