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1-BROMO-7-TERT.-BUTYL-3-ETHYLPYRENE
SpectraBase Compound ID 6GrVECmEcI8
InChI InChI=1S/C22H21Br/c1-5-13-12-19(23)18-9-7-15-11-16(22(2,3)4)10-14-6-8-17(13)21(18)20(14)15/h6-12H,5H2,1-4H3
InChIKey FQCDSFRTQALMGR-UHFFFAOYSA-N
Mol Weight 365.31 g/mol
Molecular Formula C22H21Br
Exact Mass 364.082664 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6zD1NbdXLzh
Name 1-BROMO-7-TERT.-BUTYL-3-ETHYLPYRENE
CAS Registry Number 138060-68-1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H21Br
InChI InChI=1S/C22H21Br/c1-5-13-12-19(23)18-9-7-15-11-16(22(2,3)4)10-14-6-8-17(13)21(18)20(14)15/h6-12H,5H2,1-4H3
InChIKey FQCDSFRTQALMGR-UHFFFAOYSA-N
Literature Reference Author M.MINABE,M.ISHIDA,T.KIMURA,M.TSUBOTA,M.YOSHIDA
Literature Reference Citation J.ORG.CHEM.,57,1012(1992)
Literature Reference DOI 10.1021/jo00029a044
Molecular Weight 365.313 g/mol
Solvent CDCl3
Source File Reference UWCS975