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TRI-(4-TERT.-OCTYLPHENOXY)-PENTAERYTHRITYL-BROMIDE
SpectraBase Compound ID 5ojrZ5jwvVP
InChI InChI=1S/C47H71BrO3/c1-41(2,3)28-44(10,11)35-16-22-38(23-17-35)49-32-47(31-48,33-50-39-24-18-36(19-25-39)45(12,13)29-42(4,5)6)34-51-40-26-20-37(21-27-40)46(14,15)30-43(7,8)9/h16-27H,28-34H2,1-15H3
InChIKey IMURCNGROXBHEJ-UHFFFAOYSA-N
Mol Weight 764.0 g/mol
Molecular Formula C47H71BrO3
Exact Mass 762.458659 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D1OxifHu4w8
Name TRI-(4-TERT.-OCTYLPHENOXY)-PENTAERYTHRITYL-BROMIDE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C47H71BrO3
InChI InChI=1S/C47H71BrO3/c1-41(2,3)28-44(10,11)35-16-22-38(23-17-35)49-32-47(31-48,33-50-39-24-18-36(19-25-39)45(12,13)29-42(4,5)6)34-51-40-26-20-37(21-27-40)46(14,15)30-43(7,8)9/h16-27H,28-34H2,1-15H3
InChIKey IMURCNGROXBHEJ-UHFFFAOYSA-N
Literature Reference Author S.P.DRAFFIN,P.J.DUGGAN,S.A.M.DUGGAN
Literature Reference Citation ORG.LETTERS,3,917(2001)
Literature Reference DOI 10.1021/ol015560x
Molecular Weight 763.983 g/mol
Solvent CDCl3
Source File Reference UWLU33755