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(4E)-5-methyl-2-(4-nitrophenyl)-4-{[(2-{4-[(2E)-3-phenyl-2-propenoyl]-1-piperazinyl}ethyl)amino]methylene}-2,4-dihydro-3H-pyrazol-3-one
SpectraBase Compound ID 2mOPbCNJBAf
InChI InChI=1S/C26H28N6O4/c1-20-24(26(34)31(28-20)22-8-10-23(11-9-22)32(35)36)19-27-13-14-29-15-17-30(18-16-29)25(33)12-7-21-5-3-2-4-6-21/h2-12,19,27H,13-18H2,1H3/b12-7+,24-19+
InChIKey IOCBDBQBMZRLSN-WNLZPUCHSA-N
Mol Weight 488.55 g/mol
Molecular Formula C26H28N6O4
Exact Mass 488.217203 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DpsZPw3HOn3
Name (4E)-5-methyl-2-(4-nitrophenyl)-4-{[(2-{4-[(2E)-3-phenyl-2-propenoyl]-1-piperazinyl}ethyl)amino]methylene}-2,4-dihydro-3H-pyrazol-3-one
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/C26H28N6O4/c1-20-24(26(34)31(28-20)22-8-10-23(11-9-22)32(35)36)19-27-13-14-29-15-17-30(18-16-29)25(33)12-7-21-5-3-2-4-6-21/h2-12,19,27H,13-18H2,1H3/b12-7+,24-19+
InChIKey IOCBDBQBMZRLSN-WNLZPUCHSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_16815
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/8086240; Labnumber: PR-0000268; UZI_ID: UZI-016819
Synonyms 5-methyl-2-(4-nitrophenyl)-4-{[(2-{4-[3-phenyl-2-propenoyl]-1-piperazinyl}ethyl)amino]methylene}-2,4-dihydro-3H-pyrazol-3-one
Temperature 308 °C