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4,4-DIFLUORO-3-[(1,1-BIPHENYL)-4-YL]-2,5-DIPHENYL-8-TRIFLUOROMETHYL-4-BORA-3A,4A-DIAZA-S-INDACENE
SpectraBase Compound ID 9X8pm72I0Wq
InChI InChI=1S/C34H22BF5N2/c36-34(37,38)32-30-21-20-29(26-14-8-3-9-15-26)41(30)35(39,40)42-31(32)22-28(25-12-6-2-7-13-25)33(42)27-18-16-24(17-19-27)23-10-4-1-5-11-23/h1-22H
InChIKey MZKFULQJKJJPOR-UHFFFAOYSA-N
Mol Weight 564.4 g/mol
Molecular Formula C34H22BF5N2
Exact Mass 564.17962 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J1uxCh0ecjZ
Name 4,4-DIFLUORO-3-[(1,1-BIPHENYL)-4-YL]-2,5-DIPHENYL-8-TRIFLUOROMETHYL-4-BORA-3A,4A-DIAZA-S-INDACENE
Compound Number 3AG
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H22BF5N2
InChI InChI=1S/C34H22BF5N2/c36-34(37,38)32-30-21-20-29(26-14-8-3-9-15-26)41(30)35(39,40)42-31(32)22-28(25-12-6-2-7-13-25)33(42)27-18-16-24(17-19-27)23-10-4-1-5-11-23/h1-22H
InChIKey MZKFULQJKJJPOR-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 564.364 g/mol
Solvent CDCl3
Source File Reference UWBT18788