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2-[(1H-benzimidazol-2-ylsulfanyl)methyl]-1-methyl-1H-indole-3-carbonitrile
SpectraBase Compound ID 4YtFT4W1iZA
InChI InChI=1S/C18H14N4S/c1-22-16-9-5-2-6-12(16)13(10-19)17(22)11-23-18-20-14-7-3-4-8-15(14)21-18/h2-9H,11H2,1H3,(H,20,21)
InChIKey IPXRIRWGFWMYQK-UHFFFAOYSA-N
Mol Weight 318.4 g/mol
Molecular Formula C18H14N4S
Exact Mass 318.093918 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8HeCuD4V4ij
Name 2-[(1H-benzimidazol-2-ylsulfanyl)methyl]-1-methyl-1H-indole-3-carbonitrile
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 318.093917641 u
Formula C18H14N4S
InChI InChI=1S/C18H14N4S/c1-22-16-9-5-2-6-12(16)13(10-19)17(22)11-23-18-20-14-7-3-4-8-15(14)21-18/h2-9H,11H2,1H3,(H,20,21)
InChIKey IPXRIRWGFWMYQK-UHFFFAOYSA-N
Molecular Weight 318.398 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_4988
Solvent DMSO-d6
Source Vendor ID: NMR/12267673; Lab Info: JMR; Lab Number: JMR-0002180