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2-[2-[2-[(10bS,10cS)-2,7-ditert-butyl-5-[2-[4-tert-butyl-2-[2-tri(propan-2-yl)silylethynyl]phenyl]ethynyl]-10b,10c-dimethylpyren-4-yl]ethynyl]-5-tert-butylphenyl]ethynyl-tri(propan-2-yl)silane
SpectraBase Compound ID LEPDYDsR4Ws
InChI InChI=1S/C72H96Si2/c1-47(2)73(48(3)4,49(5)6)39-37-55-41-57(67(13,14)15)31-27-53(55)29-35-63-64(36-30-54-28-32-58(68(16,17)18)42-56(54)38-40-74(50(7)8,51(9)10)52(11)12)66-46-62(70(22,23)24)44-60-34-33-59-43-61(69(19,20)21)45-65(63)71(59,25)72(60,66)26/h27-28,31-34,41-52H,1-26H3/t71-,72-/m0/s1
InChIKey MLBSXVPUJRDQPO-TVMORXBRSA-N
Mol Weight 1017.7 g/mol
Molecular Formula C72H96Si2
Exact Mass 1016.705056 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9r8A89Lq2vj
Name 2-[2-[2-[(10bS,10cS)-2,7-ditert-butyl-5-[2-[4-tert-butyl-2-[2-tri(propan-2-yl)silylethynyl]phenyl]ethynyl]-10b,10c-dimethylpyren-4-yl]ethynyl]-5-tert-butylphenyl]ethynyl-tri(propan-2-yl)silane
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C72H96Si2
InChI InChI=1S/C72H96Si2/c1-47(2)73(48(3)4,49(5)6)39-37-55-41-57(67(13,14)15)31-27-53(55)29-35-63-64(36-30-54-28-32-58(68(16,17)18)42-56(54)38-40-74(50(7)8,51(9)10)52(11)12)66-46-62(70(22,23)24)44-60-34-33-59-43-61(69(19,20)21)45-65(63)71(59,25)72(60,66)26/h27-28,31-34,41-52H,1-26H3/t71-,72-/m0/s1
InChIKey MLBSXVPUJRDQPO-TVMORXBRSA-N
Literature Reference Author D.B.KIMBALL,M.M.HALEY
Literature Reference Citation J.ORG.CHEM.,67,8798(2002)
Literature Reference DOI 10.1021/jo020462q
Molecular Weight 1017.725 g/mol
Solvent CDCl3
Source File Reference UWVN23774