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5(4H)-oxazolone, 2-(4-chlorophenyl)-4-[[8-methyl-2-(phenylthio)-3-quinolinyl]methylene]-, (4E)-
SpectraBase Compound ID DaQcfMzjIVx
InChI InChI=1S/C26H17ClN2O2S/c1-16-6-5-7-18-14-19(25(29-23(16)18)32-21-8-3-2-4-9-21)15-22-26(30)31-24(28-22)17-10-12-20(27)13-11-17/h2-15H,1H3/b22-15+
InChIKey PRLHNIQTMSXSKP-PXLXIMEGSA-N
Mol Weight 456.95 g/mol
Molecular Formula C26H17ClN2O2S
Exact Mass 456.069927 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID yCYYTLrj31
Name 5(4H)-oxazolone, 2-(4-chlorophenyl)-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 456.069926667 u
Formula C26H17ClN2O2S
InChI InChI=1S/C26H17ClN2O2S/c1-16-6-5-7-18-14-19(25(29-23(16)18)32-21-8-3-2-4-9-21)15-22-26(30)31-24(28-22)17-10-12-20(27)13-11-17/h2-15H,1H3/b22-15+
InChIKey PRLHNIQTMSXSKP-PXLXIMEGSA-N
Molecular Weight 456.947 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2409
Solvent DMSO-d6
Source Vendor ID: NMR/13268753