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2-{3-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-2-thioxo-1-[3-(trifluoromethyl)phenyl]-4-imidazolidinyl}-N-methylacetamide
SpectraBase Compound ID G33oHf2JRUk
InChI InChI=1S/C23H24F3N3O4S/c1-27-20(30)13-17-21(31)29(16-6-4-5-15(12-16)23(24,25)26)22(34)28(17)10-9-14-7-8-18(32-2)19(11-14)33-3/h4-8,11-12,17H,9-10,13H2,1-3H3,(H,27,30)
InChIKey LNXGKALDWZXWAL-UHFFFAOYSA-N
Mol Weight 495.52 g/mol
Molecular Formula C23H24F3N3O4S
Exact Mass 495.143962 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Hqop5RSSOKA
Name 4-imidazolidineacetamide, 3-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5-oxo-2-thioxo-1-[3-(trifluoromethyl)phenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 495.143961924 u
Formula C23H24F3N3O4S
InChI InChI=1S/C23H24F3N3O4S/c1-27-20(30)13-17-21(31)29(16-6-4-5-15(12-16)23(24,25)26)22(34)28(17)10-9-14-7-8-18(32-2)19(11-14)33-3/h4-8,11-12,17H,9-10,13H2,1-3H3,(H,27,30)
InChIKey LNXGKALDWZXWAL-UHFFFAOYSA-N
Molecular Weight 495.517 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_6697
Solvent DMSO-d6
Source Vendor ID: NMR/10220277; Lab Info: PE; Lab Number: PE-0790246