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N-(4-{(2Z)-2-[3-amino-5-oxo-1-(2,4,6-trichlorophenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}-2,5-dimethoxyphenyl)acetamide
SpectraBase Compound ID 2w9DhK53kdi
InChI InChI=1S/C19H17Cl3N6O4/c1-8(29)24-12-6-15(32-3)13(7-14(12)31-2)25-26-16-18(23)27-28(19(16)30)17-10(21)4-9(20)5-11(17)22/h4-7,25H,1-3H3,(H2,23,27)(H,24,29)/b26-16-
InChIKey VHFYQIYVGCCSJX-QQXSKIMKSA-N
Mol Weight 499.74 g/mol
Molecular Formula C19H17Cl3N6O4
Exact Mass 498.037686 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6GzjGJNHCQS
Name N-(4-{(2Z)-2-[3-amino-5-oxo-1-(2,4,6-trichlorophenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}-2,5-dimethoxyphenyl)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/C19H17Cl3N6O4/c1-8(29)24-12-6-15(32-3)13(7-14(12)31-2)25-26-16-18(23)27-28(19(16)30)17-10(21)4-9(20)5-11(17)22/h4-7,25H,1-3H3,(H2,23,27)(H,24,29)/b26-16-
InChIKey VHFYQIYVGCCSJX-QQXSKIMKSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_17442
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/9055981; Labnumber: SDM-2701; UZI_ID: UZI-017449
Synonyms N-(4-{2-[3-amino-5-oxo-1-(2,4,6-trichlorophenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}-2,5-dimethoxyphenyl)acetamide
Temperature 318 °C