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4,4-DIFLUORO-3-[(1,1-BIPHENYL)-4-YL]-5-PHENYL-8-TRIFLUOROMETHYL-4-BORA-3A,4A-DIAZA-S-INDACENE
SpectraBase Compound ID L83oH40EfNd
InChI InChI=1S/C28H18BF5N2/c30-28(31,32)27-25-17-15-23(21-9-5-2-6-10-21)35(25)29(33,34)36-24(16-18-26(27)36)22-13-11-20(12-14-22)19-7-3-1-4-8-19/h1-18H
InChIKey XSBZTNQSVQIXQS-UHFFFAOYSA-N
Mol Weight 488.3 g/mol
Molecular Formula C28H18BF5N2
Exact Mass 488.14832 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9y9D0cUUNfn
Name 4,4-DIFLUORO-3-[(1,1-BIPHENYL)-4-YL]-5-PHENYL-8-TRIFLUOROMETHYL-4-BORA-3A,4A-DIAZA-S-INDACENE
Compound Number 3A F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H18BF5N2
InChI InChI=1S/C28H18BF5N2/c30-28(31,32)27-25-17-15-23(21-9-5-2-6-10-21)35(25)29(33,34)36-24(16-18-26(27)36)22-13-11-20(12-14-22)19-7-3-1-4-8-19/h1-18H
InChIKey XSBZTNQSVQIXQS-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 488.266 g/mol
Solvent CDCl3
Source File Reference UWBT18787