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acetamide, 2-[[4-(1,3-benzodioxol-5-yl)-1-phenyl-1H-imidazol-2-yl]thio]-N-(3-methylphenyl)-
SpectraBase Compound ID LbYeE2IZ5py
InChI InChI=1S/C25H21N3O3S/c1-17-6-5-7-19(12-17)26-24(29)15-32-25-27-21(14-28(25)20-8-3-2-4-9-20)18-10-11-22-23(13-18)31-16-30-22/h2-14H,15-16H2,1H3,(H,26,29)
InChIKey STFXTTGUQAEAJA-UHFFFAOYSA-N
Mol Weight 443.52 g/mol
Molecular Formula C25H21N3O3S
Exact Mass 443.130363 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JeuK3rNBRmv
Name acetamide, 2-[[4-(1,3-benzodioxol-5-yl)-1-phenyl-1H-imidazol-2-yl]thio]-N-(3-methylphenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 443.130362719 u
Formula C25H21N3O3S
InChI InChI=1S/C25H21N3O3S/c1-17-6-5-7-19(12-17)26-24(29)15-32-25-27-21(14-28(25)20-8-3-2-4-9-20)18-10-11-22-23(13-18)31-16-30-22/h2-14H,15-16H2,1H3,(H,26,29)
InChIKey STFXTTGUQAEAJA-UHFFFAOYSA-N
Molecular Weight 443.521 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_4206
Solvent DMSO-d6
Source Vendor ID: NMR/13279727