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5(4H)-oxazolone, 4-[[2-[(4-chlorophenyl)thio]-8-methyl-3-quinolinyl]methylene]-2-methyl-, (4E)-
SpectraBase Compound ID KETRu702YH1
InChI InChI=1S/C21H15ClN2O2S/c1-12-4-3-5-14-10-15(11-18-21(25)26-13(2)23-18)20(24-19(12)14)27-17-8-6-16(22)7-9-17/h3-11H,1-2H3/b18-11+
InChIKey WWZHZSYTVSLULI-WOJGMQOQSA-N
Mol Weight 394.88 g/mol
Molecular Formula C21H15ClN2O2S
Exact Mass 394.054277 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5dNatP04qfr
Name 5(4H)-oxazolone, 4-[[2-[(4-chlorophenyl)thio]-8-methyl-3-quinolinyl]methylene]-2-methyl-, (4E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 394.054276603 u
Formula C21H15ClN2O2S
InChI InChI=1S/C21H15ClN2O2S/c1-12-4-3-5-14-10-15(11-18-21(25)26-13(2)23-18)20(24-19(12)14)27-17-8-6-16(22)7-9-17/h3-11H,1-2H3/b18-11+
InChIKey WWZHZSYTVSLULI-WOJGMQOQSA-N
Molecular Weight 394.876 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2467
Solvent DMSO-d6
Source Vendor ID: NMR/13268820