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ethyl {5-bromo-2-ethoxy-4-[(Z)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}acetate
SpectraBase Compound ID LmCwDG0EwuX
InChI InChI=1S/C23H23BrN2O5/c1-4-29-20-12-16(19(24)13-21(20)31-14-22(27)30-5-2)11-18-15(3)25-26(23(18)28)17-9-7-6-8-10-17/h6-13H,4-5,14H2,1-3H3/b18-11-
InChIKey NUYVNXJCIRFFIF-WQRHYEAKSA-N
Mol Weight 487.35 g/mol
Molecular Formula C23H23BrN2O5
Exact Mass 486.079035 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID D0evBbQvsbY
Name ethyl {5-bromo-2-ethoxy-4-[(Z)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}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/C23H23BrN2O5/c1-4-29-20-12-16(19(24)13-21(20)31-14-22(27)30-5-2)11-18-15(3)25-26(23(18)28)17-9-7-6-8-10-17/h6-13H,4-5,14H2,1-3H3/b18-11-
InChIKey NUYVNXJCIRFFIF-WQRHYEAKSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13132
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/9059052; UBI_ID: UBI-013135
Synonyms ethyl {5-bromo-2-ethoxy-4-[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}acetate
Temperature 308 °C