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4-CHLORO-6-TRIFLUOROMETHYL-1H-BENZIMIDAZOLE
SpectraBase Compound ID 3ism7bCr60v
InChI InChI=1S/C8H4ClF3N2O/c9-4-1-3(8(10,11)12)2-5-6(4)14-7(15)13-5/h1-2H,(H2,13,14,15)
InChIKey BBJWTCNZXPQTHJ-UHFFFAOYSA-N
Mol Weight 236.58 g/mol
Molecular Formula C8H4ClF3N2O
Exact Mass 235.996425 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID As7bRyRyO3E
Name 4-CHLORO-6-TRIFLUOROMETHYL-1H-BENZIMIDAZOLE
Compound Number 29
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H4ClF3N2O
InChI InChI=1S/C8H4ClF3N2O/c9-4-1-3(8(10,11)12)2-5-6(4)14-7(15)13-5/h1-2H,(H2,13,14,15)
InChIKey BBJWTCNZXPQTHJ-UHFFFAOYSA-N
Literature Reference Author P.A.C.CAFIERO,C.S.FRENCH,M.D.MCFARLANE,R.K.MACKIE,D.M.SMITH
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1375(1997)
Literature Reference DOI 10.1039/a607378f
Molecular Weight 236.581 g/mol
Solvent DMSO-D6
Source File Reference UWRU9896