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acetamide, N-[4-[[4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]-1-piperazinyl]sulfonyl]phenyl]-
SpectraBase Compound ID 7uhJTmIXI8R
InChI InChI=1S/C23H26N6O5S/c1-16-14-17(2)28(25-16)23-15-20(6-9-22(23)29(31)32)26-10-12-27(13-11-26)35(33,34)21-7-4-19(5-8-21)24-18(3)30/h4-9,14-15H,10-13H2,1-3H3,(H,24,30)
InChIKey VDTDFFNIYOIPTH-UHFFFAOYSA-N
Mol Weight 498.56 g/mol
Molecular Formula C23H26N6O5S
Exact Mass 498.168539 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 10vElG69pjH
Name acetamide, N-[4-[[4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]-1-piperazinyl]sulfonyl]phenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 498.168539130 u
Formula C23H26N6O5S
InChI InChI=1S/C23H26N6O5S/c1-16-14-17(2)28(25-16)23-15-20(6-9-22(23)29(31)32)26-10-12-27(13-11-26)35(33,34)21-7-4-19(5-8-21)24-18(3)30/h4-9,14-15H,10-13H2,1-3H3,(H,24,30)
InChIKey VDTDFFNIYOIPTH-UHFFFAOYSA-N
Molecular Weight 498.558 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16285
Solvent DMSO-d6
Source Vendor ID: NMR/10321287; Lab Info: LP; Lab Number: LP-2501536