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(3R,5RS)-3,7-DIMETHYL-1-IODO-3,5-OCTANEDIOL-PARA-METHOXYBENZYLIDENACETAL
SpectraBase Compound ID H5fNw74VX8q
InChI InChI=1S/C18H27IO3/c1-13(2)11-16-12-18(3,9-10-19)22-17(21-16)14-5-7-15(20-4)8-6-14/h5-8,13,16-17H,9-12H2,1-4H3/t16?,17?,18-/m1/s1
InChIKey PVWDHBJIQFFFQF-DAWZGUTISA-N
Mol Weight 418.32 g/mol
Molecular Formula C18H27IO3
Exact Mass 418.10049 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lepm3pPPrh5
Name (3R,5RS)-3,7-DIMETHYL-1-IODO-3,5-OCTANEDIOL-PARA-METHOXYBENZYLIDENACETAL
Compound Number 17-MAIN-ISOMER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H27IO3
InChI InChI=1S/C18H27IO3/c1-13(2)11-16-12-18(3,9-10-19)22-17(21-16)14-5-7-15(20-4)8-6-14/h5-8,13,16-17H,9-12H2,1-4H3/t16?,17?,18-/m1/s1
InChIKey PVWDHBJIQFFFQF-DAWZGUTISA-N
Literature Reference Author L.F.TIETZE,C.WEGNER,C.WULFF
Literature Reference Citation CHEM.EUR.J.,5,2885(1999)
Literature Reference DOI 10.1002/(sici)1521-3765(19991001)5:10<2885::aid-chem2885>3.0.co;2-8
Molecular Weight 418.315 g/mol
Solvent CDCl3
Source File Reference UWVP7199