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3H-pyrazol-3-one, 4-[[(4-bromophenyl)amino]methylene]-2,4-dihydro-5-methyl-2-(4-methylphenyl)-, (4Z)-
SpectraBase Compound ID ezKkTTioWo
InChI InChI=1S/C18H16BrN3O/c1-12-3-9-16(10-4-12)22-18(23)17(13(2)21-22)11-20-15-7-5-14(19)6-8-15/h3-11,20H,1-2H3/b17-11-
InChIKey ATYYHJDNQJKLNV-BOPFTXTBSA-N
Mol Weight 370.25 g/mol
Molecular Formula C18H16BrN3O
Exact Mass 369.047675 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EfCHRhxivEG
Name 3H-pyrazol-3-one, 4-[[(4-bromophenyl)amino]methylene]-2,4-dihydro-5-methyl-2-(4-methylphenyl)-, (4Z)-
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/C18H16BrN3O/c1-12-3-9-16(10-4-12)22-18(23)17(13(2)21-22)11-20-15-7-5-14(19)6-8-15/h3-11,20H,1-2H3/b17-11-
InChIKey ATYYHJDNQJKLNV-BOPFTXTBSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_1599
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: AG-205/5058030; Labnumber: MAR1181; IOH_ID: IOH-008602