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3-{(2E)-2-[3-amino-5-oxo-1-(2,4,6-trichlorophenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}-4-chloro-N-phenylbenzamide
SpectraBase Compound ID Iwe7yHmr6uz
InChI InChI=1S/C22H14Cl4N6O2/c23-12-9-15(25)19(16(26)10-12)32-22(34)18(20(27)31-32)30-29-17-8-11(6-7-14(17)24)21(33)28-13-4-2-1-3-5-13/h1-10,29H,(H2,27,31)(H,28,33)/b30-18+
InChIKey AJEGKXQMMKUWEL-UXHLAJHPSA-N
Mol Weight 536.2 g/mol
Molecular Formula C22H14Cl4N6O2
Exact Mass 533.993235 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IVaUNf9TrTl
Name 3-{(2E)-2-[3-amino-5-oxo-1-(2,4,6-trichlorophenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}-4-chloro-N-phenylbenzamide
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/C22H14Cl4N6O2/c23-12-9-15(25)19(16(26)10-12)32-22(34)18(20(27)31-32)30-29-17-8-11(6-7-14(17)24)21(33)28-13-4-2-1-3-5-13/h1-10,29H,(H2,27,31)(H,28,33)/b30-18+
InChIKey AJEGKXQMMKUWEL-UXHLAJHPSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13141
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/9061030; UBI_ID: UBI-013144
Synonyms 3-{2-[3-amino-5-oxo-1-(2,4,6-trichlorophenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}-4-chloro-N-phenylbenzamide
Temperature 318 °C