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(1S*,2S*,5R*,6R*)-3-Acetoxy-2,5-bis[(tert-butyldimethylsilyl)oxy]-7-oxabicyclo[4.1.0]heptane-3-carbonitrile
SpectraBase Compound ID 2kTSHdkeUo1
InChI InChI=1S/C21H39NO5Si2/c1-14(23)25-21(13-22)12-15(26-28(8,9)19(2,3)4)16-17(24-16)18(21)27-29(10,11)20(5,6)7/h15-18H,12H2,1-11H3/t15-,16+,17+,18+,21?/m1/s1
InChIKey VYXXLZCCAKRNKW-OYQSTEMFSA-N
Mol Weight 441.7 g/mol
Molecular Formula C21H39NO5Si2
Exact Mass 441.236676 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E0oFlh0JeaE
Name (1S*,2S*,5R*,6R*)-3-Acetoxy-2,5-bis[(tert-butyldimethylsilyl)oxy]-7-oxabicyclo[4.1.0]heptane-3-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H39NO5Si2
InChI InChI=1S/C21H39NO5Si2/c1-14(23)25-21(13-22)12-15(26-28(8,9)19(2,3)4)16-17(24-16)18(21)27-29(10,11)20(5,6)7/h15-18H,12H2,1-11H3/t15-,16+,17+,18+,21?/m1/s1
InChIKey VYXXLZCCAKRNKW-OYQSTEMFSA-N
Molecular Weight 441.715 g/mol
SMILES [C@]12([C@@]([C@](O[Si](C(C)(C)C)(C)C)(CC([C@]2(O[Si](C(C)(C)C)(C)C)[H])(C#N)OC(=O)C)[H])([H])O1)[H]
SPLASH splash10-00di-9300000000-4f95a7440436804de902
Source of Spectrum J-57-4730-4
Synonyms (1S,2S,5R,6R)-2,5-bis{[tert-butyl(dimethyl)silyl]oxy}-3-cyano-7-oxabicyclo[4.1.0]hept-3-yl acetate
Wiley ID 1385033