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5(4H)-oxazolone, 2-(3-methylphenyl)-4-[[8-methyl-2-(phenylthio)-3-quinolinyl]methylene]-, (4E)-
SpectraBase Compound ID JZnNPCgvyG8
InChI InChI=1S/C27H20N2O2S/c1-17-8-6-11-20(14-17)25-28-23(27(30)31-25)16-21-15-19-10-7-9-18(2)24(19)29-26(21)32-22-12-4-3-5-13-22/h3-16H,1-2H3/b23-16+
InChIKey VXSGLRJUUACFGN-XQNSMLJCSA-N
Mol Weight 436.53 g/mol
Molecular Formula C27H20N2O2S
Exact Mass 436.124549 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KrMy12snlm
Name 5(4H)-oxazolone, 2-(3-methylphenyl)-4-[[8-methyl-2-(phenylthio)-3-quinolinyl]methylene]-, (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 436.124549064 u
Formula C27H20N2O2S
InChI InChI=1S/C27H20N2O2S/c1-17-8-6-11-20(14-17)25-28-23(27(30)31-25)16-21-15-19-10-7-9-18(2)24(19)29-26(21)32-22-12-4-3-5-13-22/h3-16H,1-2H3/b23-16+
InChIKey VXSGLRJUUACFGN-XQNSMLJCSA-N
Molecular Weight 436.529 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2482
Solvent DMSO-d6
Source Vendor ID: NMR/13268838