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methyl (2-{(Z)-[1-(4-chlorophenyl)-3-methyl-5-oxo-2-thioxo-4-imidazolidinylidene]methyl}phenoxy)acetate
SpectraBase Compound ID 2a1uvlp1Q9X
InChI InChI=1S/C20H17ClN2O4S/c1-22-16(11-13-5-3-4-6-17(13)27-12-18(24)26-2)19(25)23(20(22)28)15-9-7-14(21)8-10-15/h3-11H,12H2,1-2H3/b16-11-
InChIKey XFYCYJHAVKHZFE-WJDWOHSUSA-N
Mol Weight 416.88 g/mol
Molecular Formula C20H17ClN2O4S
Exact Mass 416.059756 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8Lhi8eWSPvw
Name methyl (2-{(Z)-[1-(4-chlorophenyl)-3-methyl-5-oxo-2-thioxo-4-imidazolidinylidene]methyl}phenoxy)acetate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 416.059755905 u
Formula C20H17ClN2O4S
InChI InChI=1S/C20H17ClN2O4S/c1-22-16(11-13-5-3-4-6-17(13)27-12-18(24)26-2)19(25)23(20(22)28)15-9-7-14(21)8-10-15/h3-11H,12H2,1-2H3/b16-11-
InChIKey XFYCYJHAVKHZFE-WJDWOHSUSA-N
Molecular Weight 416.879 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1136
Solvent DMSO-d6
Source Vendor ID: NMR/12269233