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(E)-3-[1-HYDROXY-1-(2-METHYLPHENYL)-METHYL]-1,1,5,5-TETRAMETHYL-2-OXO-3-HEXENYL-N,N-DIISOPROPYLCARBAMATE

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(E)-3-[1-HYDROXY-1-(2-METHYLPHENYL)-METHYL]-1,1,5,5-TETRAMETHYL-2-OXO-3-HEXENYL-N,N-DIISOPROPYLCARBAMATE
SpectraBase Compound ID 8NAgVSiUicp
InChI InChI=1S/2C25H39NO4/c2*1-16(2)26(17(3)4)23(29)30-25(9,10)22(28)20(15-24(6,7)8)21(27)19-13-11-18(5)12-14-19/h2*11-17,21,27H,1-10H3/b2*20-15+
InChIKey WTQPWLLGFPOQTP-BWKKSXASSA-N
Mol Weight 835.2 g/mol
Molecular Formula C50H78N2O8
Exact Mass 834.575817 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GZmfzlMCXrX
Name (E)-3-[1-HYDROXY-1-(2-METHYLPHENYL)-METHYL]-1,1,5,5-TETRAMETHYL-2-OXO-3-HEXENYL-N,N-DIISOPROPYLCARBAMATE
Compound Number (E)-11E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C50H78N2O8
InChI InChI=1S/2C25H39NO4/c2*1-16(2)26(17(3)4)23(29)30-25(9,10)22(28)20(15-24(6,7)8)21(27)19-13-11-18(5)12-14-19/h2*11-17,21,27H,1-10H3/b2*20-15+
InChIKey WTQPWLLGFPOQTP-BWKKSXASSA-N
Literature Reference Author N.GUDIMALLA,R.FROEHLICH,D.HOPPE
Literature Reference Citation ORG.LETTERS,6,4005(2004)
Literature Reference DOI 10.1021/ol0483908
Molecular Weight 835.178 g/mol
Sample ID 38951
Solvent CDCl3