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5-Chloro-1-(1-methyl-3-phenyl-propyl)-1H-benzoimidazole-2-thiol

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

5-Chloro-1-(1-methyl-3-phenyl-propyl)-1H-benzoimidazole-2-thiol
SpectraBase Compound ID EMjmQY2Dr6C
InChI InChI=1S/C17H17ClN2S/c1-12(7-8-13-5-3-2-4-6-13)20-16-10-9-14(18)11-15(16)19-17(20)21/h2-6,9-12H,7-8H2,1H3,(H,19,21)
InChIKey RNDZJBDDKDIPLI-UHFFFAOYSA-N
Mol Weight 316.85 g/mol
Molecular Formula C17H17ClN2S
Exact Mass 316.080097 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9zS3rqwnhss
Name 1H-benzimidazole-2-thiol, 5-chloro-1-(1-methyl-3-phenylpropyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 316.080097429 u
Formula C17H17ClN2S
InChI InChI=1S/C17H17ClN2S/c1-12(7-8-13-5-3-2-4-6-13)20-16-10-9-14(18)11-15(16)19-17(20)21/h2-6,9-12H,7-8H2,1H3,(H,19,21)
InChIKey RNDZJBDDKDIPLI-UHFFFAOYSA-N
Molecular Weight 316.850 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15172
Solvent DMSO-d6
Source Vendor ID: NMR/10311253; Lab Info: LP; Lab Number: LP-2101529