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benzonitrile, 3-chloro-4-[[(1-methyl-1H-benzimidazol-2-yl)thio]methyl]-
SpectraBase Compound ID DE7bz8rMjuf
InChI InChI=1S/C16H12ClN3S/c1-20-15-5-3-2-4-14(15)19-16(20)21-10-12-7-6-11(9-18)8-13(12)17/h2-8H,10H2,1H3
InChIKey LFTPDBVYGVQRJS-UHFFFAOYSA-N
Mol Weight 313.81 g/mol
Molecular Formula C16H12ClN3S
Exact Mass 313.044046 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 55RY9S81OeR
Name benzonitrile, 3-chloro-4-[[(1-methyl-1H-benzimidazol-2-yl)thio]methyl]-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C16H12ClN3S/c1-20-15-5-3-2-4-14(15)19-16(20)21-10-12-7-6-11(9-18)8-13(12)17/h2-8H,10H2,1H3
InChIKey LFTPDBVYGVQRJS-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_CB_8313_499
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/8325811; Labnumber: LP-0502099
Temperature 303 °C