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N-benzyl-2-(2-methoxy-4-{(Z)-[3-methyl-1-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}phenoxy)acetamide
SpectraBase Compound ID 4MDTIDCfNPY
InChI InChI=1S/C27H24N4O6/c1-18-23(27(33)30(29-18)21-9-11-22(12-10-21)31(34)35)14-20-8-13-24(25(15-20)36-2)37-17-26(32)28-16-19-6-4-3-5-7-19/h3-15H,16-17H2,1-2H3,(H,28,32)/b23-14-
InChIKey YVXMPIYISKFAQG-UCQKPKSFSA-N
Mol Weight 500.51 g/mol
Molecular Formula C27H24N4O6
Exact Mass 500.169585 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4QIthvFIsIC
Name N-benzyl-2-(2-methoxy-4-{(Z)-[3-methyl-1-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}phenoxy)acetamide
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/C27H24N4O6/c1-18-23(27(33)30(29-18)21-9-11-22(12-10-21)31(34)35)14-20-8-13-24(25(15-20)36-2)37-17-26(32)28-16-19-6-4-3-5-7-19/h3-15H,16-17H2,1-2H3,(H,28,32)/b23-14-
InChIKey YVXMPIYISKFAQG-UCQKPKSFSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_6758
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/8187236; UBI_ID: UBI-006760
Synonyms N-benzyl-2-(2-methoxy-4-{[3-methyl-1-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}phenoxy)acetamide
Temperature 308 °C