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acetamide, 2-[[4-(1,3-benzodioxol-5-yl)-1-phenyl-1H-imidazol-2-yl]thio]-N-(5-chloro-2-methoxyphenyl)-
SpectraBase Compound ID EIbhsJphEeH
InChI InChI=1S/C25H20ClN3O4S/c1-31-21-10-8-17(26)12-19(21)27-24(30)14-34-25-28-20(13-29(25)18-5-3-2-4-6-18)16-7-9-22-23(11-16)33-15-32-22/h2-13H,14-15H2,1H3,(H,27,30)
InChIKey TWJOOKVJXXWEPP-UHFFFAOYSA-N
Mol Weight 493.97 g/mol
Molecular Formula C25H20ClN3O4S
Exact Mass 493.086305 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IvUdY19CbHN
Name acetamide, 2-[[4-(1,3-benzodioxol-5-yl)-1-phenyl-1H-imidazol-2-yl]thio]-N-(5-chloro-2-methoxyphenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 493.086305006 u
Formula C25H20ClN3O4S
InChI InChI=1S/C25H20ClN3O4S/c1-31-21-10-8-17(26)12-19(21)27-24(30)14-34-25-28-20(13-29(25)18-5-3-2-4-6-18)16-7-9-22-23(11-16)33-15-32-22/h2-13H,14-15H2,1H3,(H,27,30)
InChIKey TWJOOKVJXXWEPP-UHFFFAOYSA-N
Molecular Weight 493.965 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_4211
Solvent DMSO-d6
Source Vendor ID: NMR/13279732