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4,4-DIFLUORO-8-(4'-IODOPHENYL)-1,7-BIS-(1'-NAPHTHYL)-4-BORA-3A,4A-DIAZA-S-INDANCENE
SpectraBase Compound ID KGZKmm4Y41Y
InChI InChI=1S/C35H22BF2IN2/c37-36(38)40-31(29-13-5-9-23-7-1-3-11-27(23)29)19-21-33(40)35(25-15-17-26(39)18-16-25)34-22-20-32(41(34)36)30-14-6-10-24-8-2-4-12-28(24)30/h1-22H
InChIKey SDJXSBQAERLUKD-UHFFFAOYSA-N
Mol Weight 646.3 g/mol
Molecular Formula C35H22BF2IN2
Exact Mass 646.08888 g/mol

11B Nuclear Magnetic Resonance (NMR) Chemical Shifts

11B Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1dMTlTHA4hP
Name 4,4-DIFLUORO-8-(4'-IODOPHENYL)-1,7-BIS-(1'-NAPHTHYL)-4-BORA-3A,4A-DIAZA-S-INDANCENE
Compound Number 1B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H22BF2IN2
InChI InChI=1S/C35H22BF2IN2/c37-36(38)40-31(29-13-5-9-23-7-1-3-11-27(23)29)19-21-33(40)35(25-15-17-26(39)18-16-25)34-22-20-32(41(34)36)30-14-6-10-24-8-2-4-12-28(24)30/h1-22H
InChIKey SDJXSBQAERLUKD-UHFFFAOYSA-N
Literature Reference Author A.BURGHART,H.KIM,M.B.WELCH,L.H.THORESEN,J.REIBENSPIES,K.BURG ESS,F.BERGSTROEM,L.B
Literature Reference Citation J.ORG.CHEM.,64,7813(1999)
Literature Reference DOI 10.1021/jo990796o
Solvent CDCl3
Source File Reference UWLU60089