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2-CHLORO-4-TRIFLUOROMETHYL-PYRROLO-[2,3-D]-PYRIMIDINE
SpectraBase Compound ID 8TczueA70Z3
InChI InChI=1S/C7H3ClF3N3/c8-6-13-4(7(9,10)11)3-1-2-12-5(3)14-6/h1-2H,(H,12,13,14)
InChIKey LNAHIRKCJJDHNK-UHFFFAOYSA-N
Mol Weight 221.57 g/mol
Molecular Formula C7H3ClF3N3
Exact Mass 220.996759 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L9qojwOheaN
Name 2-CHLORO-4-TRIFLUOROMETHYL-PYRROLO-[2,3-D]-PYRIMIDINE
Compound Number 12E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H3ClF3N3
InChI InChI=1S/C7H3ClF3N3/c8-6-13-4(7(9,10)11)3-1-2-12-5(3)14-6/h1-2H,(H,12,13,14)
InChIKey LNAHIRKCJJDHNK-UHFFFAOYSA-N
Literature Reference Author J.DREXLER,U.GROTH
Literature Reference Citation EUR.J.ORG.CHEM.,2014,6314(2014)
Literature Reference DOI 10.1002/ejoc.201402755
Solvent DMSO-D6
Source File Reference UWIR19259