John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=13rmifQEbzG

(accessed ).
[E,E,1S,6R,8R,10R,R(S)]-13,13-DIMETHYL-4-[2-(2,4-DINITROPHENYLHYDRAZONE)-ETHYLIDENE]-6-(4-NITROPHENYL)-7-OXA-3-THIATRICYCLO-[8.2.1.0(1,8)]-TRIDECAN
SpectraBase Compound ID 13rmifQEbzG
InChI InChI=1S/C27H29N5O8S/c1-26(2)18-9-11-27(26)16-41(39)21(10-12-28-29-22-8-7-20(31(35)36)14-23(22)32(37)38)15-24(40-25(27)13-18)17-3-5-19(6-4-17)30(33)34/h3-8,10,12,14,18,24-25,29H,9,11,13,15-16H2,1-2H3/b21-10+,28-12+/t18-,24?,25?,27?,41?/m0/s1
InChIKey WNOWMPHPDYEGJV-PIXOKTEVSA-N
Mol Weight 583.62 g/mol
Molecular Formula C27H29N5O8S
Exact Mass 583.173685 g/mol
Enantiomer InChIKey WNOWMPHPDYEGJV-IKBXUSBCSA-N
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Formation and X-ray structural study of enantiopure fused 1,5-oxathiocane derivatives Journal of the Chemical Society, Perkin Transactions 2 1997
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