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(1S,2S)-2,6-DIMETHYL-2-ETHENYL-1-(2'-NAPHTHYL)-5-HEPTENYL-4-BROMOBENZOATE
SpectraBase Compound ID CSdphMwA71O
InChI InChI=1S/C28H29BrO2/c1-5-28(4,18-8-9-20(2)3)26(31-27(30)22-14-16-25(29)17-15-22)24-13-12-21-10-6-7-11-23(21)19-24/h5-7,9-17,19,26H,1,8,18H2,2-4H3/t26-,28-/m1/s1
InChIKey DQEUBVLOMZTCND-IXCJQBJRSA-N
Mol Weight 477.44 g/mol
Molecular Formula C28H29BrO2
Exact Mass 476.135093 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BsQU7EBftwD
Name (1S,2S)-2,6-DIMETHYL-2-ETHENYL-1-(2'-NAPHTHYL)-5-HEPTENYL-4-BROMOBENZOATE
Compound Number 31
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H29BrO2
InChI InChI=1S/C28H29BrO2/c1-5-28(4,18-8-9-20(2)3)26(31-27(30)22-14-16-25(29)17-15-22)24-13-12-21-10-6-7-11-23(21)19-24/h5-7,9-17,19,26H,1,8,18H2,2-4H3/t26-,28-/m1/s1
InChIKey DQEUBVLOMZTCND-IXCJQBJRSA-N
Literature Reference Author S.E.DENMARK,J.FU
Literature Reference Citation J.AM.CHEM.SOC.,123,9488(2001)
Literature Reference DOI 10.1021/ja016552e
Molecular Weight 477.441 g/mol
Solvent CDCl3
Source File Reference UWLU32665