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4H-imidazol-4-one, 2-(butylthio)-3-(2-chloro-4-methylphenyl)-3,5-dihydro-5-[(4-methylphenyl)methylene]-, (5E)-
SpectraBase Compound ID JYMcDU7T5fk
InChI InChI=1S/C22H23ClN2OS/c1-4-5-12-27-22-24-19(14-17-9-6-15(2)7-10-17)21(26)25(22)20-11-8-16(3)13-18(20)23/h6-11,13-14H,4-5,12H2,1-3H3/b19-14+
InChIKey GKDQYJMLPLAXGO-XMHGGMMESA-N
Mol Weight 398.95 g/mol
Molecular Formula C22H23ClN2OS
Exact Mass 398.121962 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7ordtXMP48X
Name 4H-imidazol-4-one, 2-(butylthio)-3-(2-chloro-4-methylphenyl)-3,5-dihydro-5-[(4-methylphenyl)methylene]-, (5E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 398.121962242 u
Formula C22H23ClN2OS
InChI InChI=1S/C22H23ClN2OS/c1-4-5-12-27-22-24-19(14-17-9-6-15(2)7-10-17)21(26)25(22)20-11-8-16(3)13-18(20)23/h6-11,13-14H,4-5,12H2,1-3H3/b19-14+
InChIKey GKDQYJMLPLAXGO-XMHGGMMESA-N
Molecular Weight 398.952 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_3942
Solvent DMSO-d6
Source Vendor ID: NMR/13279336