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2-(1,1-BIPHENYL)-4-YL-5-[2,2,2-TRIFLUORO-1-[5-(2-THIENYL)-1H-PYRROL-2-YL]-ETHYL]-1H-PYRROLE
SpectraBase Compound ID JpXNHZMIvqg
InChI InChI=1S/C26H19F3N2S/c27-26(28,29)25(23-15-13-21(31-23)24-7-4-16-32-24)22-14-12-20(30-22)19-10-8-18(9-11-19)17-5-2-1-3-6-17/h1-16,25,30-31H
InChIKey WCRQBRFMYPGNBK-UHFFFAOYSA-N
Mol Weight 448.51 g/mol
Molecular Formula C26H19F3N2S
Exact Mass 448.122104 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hb5pON5QebU
Name 2-(1,1-BIPHENYL)-4-YL-5-[2,2,2-TRIFLUORO-1-[5-(2-THIENYL)-1H-PYRROL-2-YL]-ETHYL]-1H-PYRROLE
Compound Number 6BF
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H19F3N2S
InChI InChI=1S/C26H19F3N2S/c27-26(28,29)25(23-15-13-21(31-23)24-7-4-16-32-24)22-14-12-20(30-22)19-10-8-18(9-11-19)17-5-2-1-3-6-17/h1-16,25,30-31H
InChIKey WCRQBRFMYPGNBK-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
Solvent CDCl3
Source File Reference UWBT18777