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4,4-DIFLUORO-3,5-BIS-[(1,1-BIPHENYL)-4-YL]-2,6-DIPHENYL-8-TRIFLUOROMETHYL-4-BORA-3A,4A-DIAZA-S-INDACENE
SpectraBase Compound ID 7BSEeLkmBTS
InChI InChI=1S/C46H30BF5N2/c48-46(49,50)43-41-29-39(35-17-9-3-10-18-35)44(37-25-21-33(22-26-37)31-13-5-1-6-14-31)53(41)47(51,52)54-42(43)30-40(36-19-11-4-12-20-36)45(54)38-27-23-34(24-28-38)32-15-7-2-8-16-32/h1-30H
InChIKey BPPAEQPZCMIWGA-UHFFFAOYSA-N
Mol Weight 716.6 g/mol
Molecular Formula C46H30BF5N2
Exact Mass 716.24222 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9HYIRwGupZb
Name 4,4-DIFLUORO-3,5-BIS-[(1,1-BIPHENYL)-4-YL]-2,6-DIPHENYL-8-TRIFLUOROMETHYL-4-BORA-3A,4A-DIAZA-S-INDACENE
Compound Number 3GG
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H30BF5N2
InChI InChI=1S/C46H30BF5N2/c48-46(49,50)43-41-29-39(35-17-9-3-10-18-35)44(37-25-21-33(22-26-37)31-13-5-1-6-14-31)53(41)47(51,52)54-42(43)30-40(36-19-11-4-12-20-36)45(54)38-27-23-34(24-28-38)32-15-7-2-8-16-32/h1-30H
InChIKey BPPAEQPZCMIWGA-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 716.560 g/mol
Solvent CDCl3
Source File Reference UWBT18795