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acetic acid, [[(4E)-1-(2-chloro-4-methylphenyl)-4-[(4-ethylphenyl)methylene]-4,5-dihydro-5-oxo-1H-imidazol-2-yl]thio]-, ethyl ester

View entire compound with spectra: 1 NMR

acetic acid, [[(4E)-1-(2-chloro-4-methylphenyl)-4-[(4-ethylphenyl)methylene]-4,5-dihydro-5-oxo-1H-imidazol-2-yl]thio]-, ethyl ester
SpectraBase Compound ID 1E28P9GbUB9
InChI InChI=1S/C23H23ClN2O3S/c1-4-16-7-9-17(10-8-16)13-19-22(28)26(20-11-6-15(3)12-18(20)24)23(25-19)30-14-21(27)29-5-2/h6-13H,4-5,14H2,1-3H3/b19-13+
InChIKey ZDHFJKGMJHMYPL-CPNJWEJPSA-N
Mol Weight 442.96 g/mol
Molecular Formula C23H23ClN2O3S
Exact Mass 442.111791 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4HGQMxrQWHV
Name acetic acid, [[(4E)-1-(2-chloro-4-methylphenyl)-4-[(4-ethylphenyl)methylene]-4,5-dihydro-5-oxo-1H-imidazol-2-yl]thio]-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 442.111791480 u
Formula C23H23ClN2O3S
InChI InChI=1S/C23H23ClN2O3S/c1-4-16-7-9-17(10-8-16)13-19-22(28)26(20-11-6-15(3)12-18(20)24)23(25-19)30-14-21(27)29-5-2/h6-13H,4-5,14H2,1-3H3/b19-13+
InChIKey ZDHFJKGMJHMYPL-CPNJWEJPSA-N
Molecular Weight 442.961 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_3954
Solvent DMSO-d6
Source Vendor ID: NMR/13279349