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Acetamide, 2-(1H-benzoimidazol-2-ylmethylsulfanyl)-N-(o-tolyl)-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Acetamide, 2-(1H-benzoimidazol-2-ylmethylsulfanyl)-N-(o-tolyl)-
SpectraBase Compound ID DjPAGnX9rNO
InChI InChI=1S/C17H17N3OS/c1-12-6-2-3-7-13(12)20-17(21)11-22-10-16-18-14-8-4-5-9-15(14)19-16/h2-9H,10-11H2,1H3,(H,18,19)(H,20,21)
InChIKey OMDYKVFZFNQEAN-UHFFFAOYSA-N
Mol Weight 311.4 g/mol
Molecular Formula C17H17N3OS
Exact Mass 311.109233 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JdjjqZa3Nsq
Name Acetamide, 2-(1H-benzoimidazol-2-ylmethylsulfanyl)-N-(o-tolyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 311.109233352 u
Formula C17H17N3OS
InChI InChI=1S/C17H17N3OS/c1-12-6-2-3-7-13(12)20-17(21)11-22-10-16-18-14-8-4-5-9-15(14)19-16/h2-9H,10-11H2,1H3,(H,18,19)(H,20,21)
InChIKey OMDYKVFZFNQEAN-UHFFFAOYSA-N
Molecular Weight 311.403 g/mol
SMILES C1=CC=C2C(=C1)N=C(N2)CSCC(NC=1C(C)=CC=CC1)=O