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(6R,1E,3Z)-6-(4-BROMOPHENYL)-6-HYDROXY-5,5-DIMETHYL-1-PHENYLHEXA-1,3-DIEN-3-YL-N,N-DIISOPROPYLCARBAMATE
SpectraBase Compound ID 4rTZTHYgQIl
InChI InChI=1S/C27H34BrNO3/c1-19(2)29(20(3)4)26(31)32-24(17-12-21-10-8-7-9-11-21)18-27(5,6)25(30)22-13-15-23(28)16-14-22/h7-20,25,30H,1-6H3/b17-12+,24-18-/t25-/m0/s1
InChIKey VLTMMZUTSUPZQE-ZUQKBECJSA-N
Mol Weight 500.5 g/mol
Molecular Formula C27H34BrNO3
Exact Mass 499.172207 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IfeoHK7QDt1
Name (6R,1E,3Z)-6-(4-BROMOPHENYL)-6-HYDROXY-5,5-DIMETHYL-1-PHENYLHEXA-1,3-DIEN-3-YL-N,N-DIISOPROPYLCARBAMATE
Compound Number 18A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H34BrNO3
InChI InChI=1S/C27H34BrNO3/c1-19(2)29(20(3)4)26(31)32-24(17-12-21-10-8-7-9-11-21)18-27(5,6)25(30)22-13-15-23(28)16-14-22/h7-20,25,30H,1-6H3/b17-12+,24-18-/t25-/m0/s1
InChIKey VLTMMZUTSUPZQE-ZUQKBECJSA-N
Literature Reference Author R.B.CHEDID,R.FROEHLICH,D.HOPPE
Literature Reference Citation ORG.LETTERS,8,3061(2006)
Literature Reference DOI 10.1021/ol061005p
Molecular Weight 500.476 g/mol
Sample ID 60554
Solvent CDCl3