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5(4H)-oxazolone, 4-[[2-(phenylthio)-3-quinolinyl]methylene]-2-(3,4,5-trimethoxyphenyl)-, (4E)-
SpectraBase Compound ID 4ssPKCD2fK2
InChI InChI=1S/C28H22N2O5S/c1-32-23-15-18(16-24(33-2)25(23)34-3)26-29-22(28(31)35-26)14-19-13-17-9-7-8-12-21(17)30-27(19)36-20-10-5-4-6-11-20/h4-16H,1-3H3/b22-14+
InChIKey FHWMIMJXMHQXBK-HYARGMPZSA-N
Mol Weight 498.55 g/mol
Molecular Formula C28H22N2O5S
Exact Mass 498.124943 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4JCOQTRtvLg
Name 5(4H)-oxazolone, 4-[[2-(phenylthio)-3-quinolinyl]methylene]-2-(3,4,5-trimethoxyphenyl)-, (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 498.124942985 u
Formula C28H22N2O5S
InChI InChI=1S/C28H22N2O5S/c1-32-23-15-18(16-24(33-2)25(23)34-3)26-29-22(28(31)35-26)14-19-13-17-9-7-8-12-21(17)30-27(19)36-20-10-5-4-6-11-20/h4-16H,1-3H3/b22-14+
InChIKey FHWMIMJXMHQXBK-HYARGMPZSA-N
Molecular Weight 498.553 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2447
Solvent DMSO-d6
Source Vendor ID: NMR/13268797