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TRANS-4,5-DIBROMO-2,7-DI-TERT.-BUTYL-12C,12D-DIHYDRO-12C,12D-DIMETHYLBENZO-[E]-PYRENE
SpectraBase Compound ID H7X9OGYMee7
InChI InChI=1S/C30H32Br2/c1-27(2,3)17-13-21-19-11-9-10-12-20(19)22-14-18(28(4,5)6)16-24-26(32)25(31)23(15-17)29(21,7)30(22,24)8/h9-16H,1-8H3/t29-,30-/m0/s1
InChIKey JCIKILQGZCFVHO-KYJUHHDHSA-N
Mol Weight 552.4 g/mol
Molecular Formula C30H32Br2
Exact Mass 550.087077 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EDsPlGA8E39
Name TRANS-4,5-DIBROMO-2,7-DI-TERT.-BUTYL-12C,12D-DIHYDRO-12C,12D-DIMETHYLBENZO-[E]-PYRENE
Compound Number 36
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H32Br2
InChI InChI=1S/C30H32Br2/c1-27(2,3)17-13-21-19-11-9-10-12-20(19)22-14-18(28(4,5)6)16-24-26(32)25(31)23(15-17)29(21,7)30(22,24)8/h9-16H,1-8H3/t29-,30-/m0/s1
InChIKey JCIKILQGZCFVHO-KYJUHHDHSA-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 552.392 g/mol
Solvent CDCl3
Source File Reference UWVN23782