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5(4H)-oxazolone, 4-[[7-methyl-2-[(4-methylphenyl)thio]-3-quinolinyl]methylene]-2-(2-methylphenyl)-, (4E)-
SpectraBase Compound ID 2oy5iC6nUEm
InChI InChI=1S/C28H22N2O2S/c1-17-9-12-22(13-10-17)33-27-21(15-20-11-8-18(2)14-24(20)30-27)16-25-28(31)32-26(29-25)23-7-5-4-6-19(23)3/h4-16H,1-3H3/b25-16+
InChIKey FRJAUUMUSQXTJK-PCLIKHOPSA-N
Mol Weight 450.56 g/mol
Molecular Formula C28H22N2O2S
Exact Mass 450.140199 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID B3KyM4edBqp
Name 5(4H)-oxazolone, 4-[[7-methyl-2-[(4-methylphenyl)thio]-3-quinolinyl]methylene]-2-(2-methylphenyl)-, (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 450.140199128 u
Formula C28H22N2O2S
InChI InChI=1S/C28H22N2O2S/c1-17-9-12-22(13-10-17)33-27-21(15-20-11-8-18(2)14-24(20)30-27)16-25-28(31)32-26(29-25)23-7-5-4-6-19(23)3/h4-16H,1-3H3/b25-16+
InChIKey FRJAUUMUSQXTJK-PCLIKHOPSA-N
Molecular Weight 450.556 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2504
Solvent DMSO-d6
Source Vendor ID: NMR/13268861