For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

benzoic acid, 5-[(4Z)-4-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylene]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]-2-chloro-

View entire compound with spectra: 1 NMR

benzoic acid, 5-[(4Z)-4-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylene]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]-2-chloro-
SpectraBase Compound ID 4hKjmmP3pw5
InChI InChI=1S/C19H14BrClN2O5/c1-9-12(5-10-6-14(20)17(24)16(7-10)28-2)18(25)23(22-9)11-3-4-15(21)13(8-11)19(26)27/h3-8,24H,1-2H3,(H,26,27)/b12-5-
InChIKey NDJFAUDLBXZCCK-XGICHPGQSA-N
Mol Weight 465.69 g/mol
Molecular Formula C19H14BrClN2O5
Exact Mass 463.977462 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9lpe3MN5Yej
Name benzoic acid, 5-[(4Z)-4-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylene]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]-2-chloro-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 463.977462254 u
Formula C19H14BrClN2O5
InChI InChI=1S/C19H14BrClN2O5/c1-9-12(5-10-6-14(20)17(24)16(7-10)28-2)18(25)23(22-9)11-3-4-15(21)13(8-11)19(26)27/h3-8,24H,1-2H3,(H,26,27)/b12-5-
InChIKey NDJFAUDLBXZCCK-XGICHPGQSA-N
Molecular Weight 465.687 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_585
Solvent DMSO-d6
Source Vendor ID: ZI/7115251; Lab Info: SAD; Lab Number: SAD-r000026
Temperature 29.85 °C