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3H-pyrazol-3-one, 2-(4-bromophenyl)-4-[[(5-chloro-2-methoxy-4-nitrophenyl)amino]methylene]-2,4-dihydro-5-methyl-, (4Z)-
SpectraBase Compound ID 7hi7r5x1AWu
InChI InChI=1S/C18H14BrClN4O4/c1-10-13(18(25)23(22-10)12-5-3-11(19)4-6-12)9-21-15-7-14(20)16(24(26)27)8-17(15)28-2/h3-9,21H,1-2H3/b13-9-
InChIKey QDBKYAPRZKTIRY-LCYFTJDESA-N
Mol Weight 465.69 g/mol
Molecular Formula C18H14BrClN4O4
Exact Mass 463.988696 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CpUXNStHv4I
Name 3H-pyrazol-3-one, 2-(4-bromophenyl)-4-[[(5-chloro-2-methoxy-4-nitrophenyl)amino]methylene]-2,4-dihydro-5-methyl-, (4Z)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 463.988695643 u
Formula C18H14BrClN4O4
InChI InChI=1S/C18H14BrClN4O4/c1-10-13(18(25)23(22-10)12-5-3-11(19)4-6-12)9-21-15-7-14(20)16(24(26)27)8-17(15)28-2/h3-9,21H,1-2H3/b13-9-
InChIKey QDBKYAPRZKTIRY-LCYFTJDESA-N
Molecular Weight 465.691 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_3423
Solvent DMSO-d6
Source Vendor ID: NMR/9278283; Lab Number: BAS 0833918
Temperature 29.85 °C