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5-chloro-3-(difluoromethyl)-1-methylbenzimidazole-2-thione
SpectraBase Compound ID L87pAliFUdt
InChI InChI=1S/C9H7ClF2N2S/c1-13-6-3-2-5(10)4-7(6)14(8(11)12)9(13)15/h2-4,8H,1H3
InChIKey PAEAEHHKLKZJCH-UHFFFAOYSA-N
Mol Weight 248.68 g/mol
Molecular Formula C9H7ClF2N2S
Exact Mass 247.998653 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1ZeNX6XbNDN
Name 5-chloro-3-(difluoromethyl)-1-methylbenzimidazole-2-thione
Compound Number 8C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H7ClF2N2S
InChI InChI=1S/C9H7ClF2N2S/c1-13-6-3-2-5(10)4-7(6)14(8(11)12)9(13)15/h2-4,8H,1H3
InChIKey PAEAEHHKLKZJCH-UHFFFAOYSA-N
Literature Reference Author W.XU,K.A.ABBOUD,I.GHIVIRIGA,W.R.DOLBIER,M.RAPP,S.F.WNUK
Literature Reference Citation ORG.LETTERS,8,5549(2006)
Literature Reference DOI 10.1021/ol062213k
Solvent CDCl3
Source File Reference UWLU53370