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3H-pyrazol-3-one, 4-[[[2-(3,4-dimethoxyphenyl)ethyl]amino]methylene]-2,4-dihydro-5-methyl-2-(4-nitrophenyl)-, (4E)-
SpectraBase Compound ID Ha0wPzBbI36
InChI InChI=1S/C21H22N4O5/c1-14-18(13-22-11-10-15-4-9-19(29-2)20(12-15)30-3)21(26)24(23-14)16-5-7-17(8-6-16)25(27)28/h4-9,12-13,22H,10-11H2,1-3H3/b18-13+
InChIKey SVBZWDUCHAFMKO-QGOAFFKASA-N
Mol Weight 410.43 g/mol
Molecular Formula C21H22N4O5
Exact Mass 410.15902 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9EmAnsS3FMD
Name 3H-pyrazol-3-one, 4-[[[2-(3,4-dimethoxyphenyl)ethyl]amino]methylene]-2,4-dihydro-5-methyl-2-(4-nitrophenyl)-, (4E)-
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/C21H22N4O5/c1-14-18(13-22-11-10-15-4-9-19(29-2)20(12-15)30-3)21(26)24(23-14)16-5-7-17(8-6-16)25(27)28/h4-9,12-13,22H,10-11H2,1-3H3/b18-13+
InChIKey SVBZWDUCHAFMKO-QGOAFFKASA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_200
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: NMR/11249939