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5(4H)-oxazolone, 4-[[2-[(4-chlorophenyl)thio]-7-methyl-3-quinolinyl]methylene]-2-[4-(1,1-dimethylethyl)phenyl]-, (4E)-
SpectraBase Compound ID 6uWWk4QJVKz
InChI InChI=1S/C30H25ClN2O2S/c1-18-5-6-20-16-21(28(33-25(20)15-18)36-24-13-11-23(31)12-14-24)17-26-29(34)35-27(32-26)19-7-9-22(10-8-19)30(2,3)4/h5-17H,1-4H3/b26-17+
InChIKey GEKMEBLQIYZASR-YZSQISJMSA-N
Mol Weight 513.06 g/mol
Molecular Formula C30H25ClN2O2S
Exact Mass 512.132527 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FW8EY1b3dLT
Name 5(4H)-oxazolone, 4-[[2-[(4-chlorophenyl)thio]-7-methyl-3-quinolinyl]methylene]-2-[4-(1,1-dimethylethyl)phenyl]-, (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 512.132526925 u
Formula C30H25ClN2O2S
InChI InChI=1S/C30H25ClN2O2S/c1-18-5-6-20-16-21(28(33-25(20)15-18)36-24-13-11-23(31)12-14-24)17-26-29(34)35-27(32-26)19-7-9-22(10-8-19)30(2,3)4/h5-17H,1-4H3/b26-17+
InChIKey GEKMEBLQIYZASR-YZSQISJMSA-N
Molecular Weight 513.055 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2443
Solvent DMSO-d6
Source Vendor ID: NMR/13268793