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1-[5-(4-CHLOROPHENYL)-1H-PYRROL-2-YL]-2,2,2-TRIFLUORO-1-ETHANOL
SpectraBase Compound ID 29f6jaDXNB7
InChI InChI=1S/C12H9ClF3NO/c13-8-3-1-7(2-4-8)9-5-6-10(17-9)11(18)12(14,15)16/h1-6,11,17-18H
InChIKey BWFPZGJYVTVCAW-UHFFFAOYSA-N
Mol Weight 275.66 g/mol
Molecular Formula C12H9ClF3NO
Exact Mass 275.032476 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1dfl5ezizEg
Name 1-[5-(4-CHLOROPHENYL)-1H-PYRROL-2-YL]-2,2,2-TRIFLUORO-1-ETHANOL
Compound Number 5E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H9ClF3NO
InChI InChI=1S/C12H9ClF3NO/c13-8-3-1-7(2-4-8)9-5-6-10(17-9)11(18)12(14,15)16/h1-6,11,17-18H
InChIKey BWFPZGJYVTVCAW-UHFFFAOYSA-N
Literature Reference Author L.N.SOBENINA,O.V.PETROVA,K.B.PETRUSHENKO,I.A.USHAKOV,A.I.MIK HALEVA,R.MEALLET-REN
Literature Reference Citation EUR.J.ORG.CHEM.,2013,4107(2013)
Literature Reference DOI 10.1002/ejoc.201300212
Molecular Weight 275.658 g/mol
Solvent CDCl3
Source File Reference UWBT18769