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(4Z)-2-[4-(1-adamantyl)phenyl]-4-({[3,5-dimethyl-1-(4-nitrophenyl)-1H-pyrazol-4-yl]amino}methylene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one

View entire compound with spectra: 1 NMR

(4Z)-2-[4-(1-adamantyl)phenyl]-4-({[3,5-dimethyl-1-(4-nitrophenyl)-1H-pyrazol-4-yl]amino}methylene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
SpectraBase Compound ID CdBRSBNooeS
InChI InChI=1S/C32H34N6O3/c1-19-29(18-33-30-20(2)35-36(21(30)3)26-8-10-28(11-9-26)38(40)41)31(39)37(34-19)27-6-4-25(5-7-27)32-15-22-12-23(16-32)14-24(13-22)17-32/h4-11,18,22-24,33H,12-17H2,1-3H3/b29-18-
InChIKey JWFHHNBOJPFQEU-MIXAMLLLSA-N
Mol Weight 550.7 g/mol
Molecular Formula C32H34N6O3
Exact Mass 550.269239 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LrDXSElYy0e
Name (4Z)-2-[4-(1-adamantyl)phenyl]-4-({[3,5-dimethyl-1-(4-nitrophenyl)-1H-pyrazol-4-yl]amino}methylene)-5-methyl-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/C32H34N6O3/c1-19-29(18-33-30-20(2)35-36(21(30)3)26-8-10-28(11-9-26)38(40)41)31(39)37(34-19)27-6-4-25(5-7-27)32-15-22-12-23(16-32)14-24(13-22)17-32/h4-11,18,22-24,33H,12-17H2,1-3H3/b29-18-
InChIKey JWFHHNBOJPFQEU-MIXAMLLLSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5925
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: 62486; UBI_ID: UBI-005927
Synonyms 2-[4-(1-adamantyl)phenyl]-4-({[3,5-dimethyl-1-(4-nitrophenyl)-1H-pyrazol-4-yl]amino}methylene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Temperature 308 °C