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5,5'-DIISOPROPYL-2,2'-DITHIOPROPANE-3,3',4,4'-TETRAMETHOXY-7,7'-DIMETHYL-2H,2'H-[8,8']-BI-[NAPHTHO-[1,8-BC]-FURANYL]
SpectraBase Compound ID 7X4hlxNsSSa
InChI InChI=1S/C37H42O6S2/c1-16(2)22-20-14-18(5)24-25-19(6)15-21-23(17(3)4)33(39-8)35(41-10)29-27(21)31(25)43-37(29)45-13-11-12-44-36-28(26(20)30(24)42-36)34(40-9)32(22)38-7/h14-17,36-37H,11-13H2,1-10H3
InChIKey NGCHJULHXPHBBT-UHFFFAOYSA-N
Mol Weight 646.9 g/mol
Molecular Formula C37H42O6S2
Exact Mass 646.242281 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JojquiaYvsi
Name 5,5'-DIISOPROPYL-2,2'-DITHIOPROPANE-3,3',4,4'-TETRAMETHOXY-7,7'-DIMETHYL-2H,2'H-[8,8']-BI-[NAPHTHO-[1,8-BC]-FURANYL]
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H42O6S2
InChI InChI=1S/C37H42O6S2/c1-16(2)22-20-14-18(5)24-25-19(6)15-21-23(17(3)4)33(39-8)35(41-10)29-27(21)31(25)43-37(29)45-13-11-12-44-36-28(26(20)30(24)42-36)34(40-9)32(22)38-7/h14-17,36-37H,11-13H2,1-10H3
InChIKey NGCHJULHXPHBBT-UHFFFAOYSA-N
Literature Reference Author V.T.DAO,M.K.DOWD,C.GASPARD,M.T.MARTIN,J.HEMEZ,O.LAPREVOTE,M. MAYER,R.J.MICHELOT
Literature Reference Citation BIOORG.MED.CHEM.,11,2001(2003)
Literature Reference DOI 10.1016/S0968-0896(03)00066-X
Molecular Weight 646.857 g/mol
Sample ID 29151
Solvent CDCl3