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5-bromo-4-{(E)-[1-(4-bromophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-methoxyphenyl acetate
SpectraBase Compound ID JnRA9Gm6Miu
InChI InChI=1S/C20H16Br2N2O4/c1-11-16(20(26)24(23-11)15-6-4-14(21)5-7-15)8-13-9-18(27-3)19(10-17(13)22)28-12(2)25/h4-10H,1-3H3/b16-8+
InChIKey WYYFYCSUMPYLIM-LZYBPNLTSA-N
Mol Weight 508.17 g/mol
Molecular Formula C20H16Br2N2O4
Exact Mass 505.947683 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HMxXCrCdGKO
Name 5-bromo-4-{(E)-[1-(4-bromophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-methoxyphenyl acetate
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/C20H16Br2N2O4/c1-11-16(20(26)24(23-11)15-6-4-14(21)5-7-15)8-13-9-18(27-3)19(10-17(13)22)28-12(2)25/h4-10H,1-3H3/b16-8+
InChIKey WYYFYCSUMPYLIM-LZYBPNLTSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16880
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/8190180; UBI_ID: UBI-016883
Synonyms 5-bromo-4-{[1-(4-bromophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-2-methoxyphenyl acetate
Temperature 313 °C