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25-(1-Adamantyl)-1a-hydroxy-2-methylidene-25-oxo-23,23,24,24-tetradehydro-19,26,27-trinorvitamin D3 1,3-Bis-(tert-butyldimethylsilyl)Ether
SpectraBase Compound ID LMS6wPyG96M
InChI InChI=1S/C47H76O3Si2/c1-32(16-14-18-43(48)47-29-35-24-36(30-47)26-37(25-35)31-47)39-21-22-40-38(17-15-23-46(39,40)9)20-19-34-27-41(49-51(10,11)44(3,4)5)33(2)42(28-34)50-52(12,13)45(6,7)8/h19-20,32,35-37,39-42H,2,15-17,21-31H2,1,3-13H3/b38-20+/t32-,35-,36+,37-,39-,40+,41-,42-,46-,47-/m1/s1
InChIKey QYIJRAKHGQWDRD-IQVFOZAKSA-N
Mol Weight 745.3 g/mol
Molecular Formula C47H76O3Si2
Exact Mass 744.533299 g/mol
Enantiomer InChIKey QYIJRAKHGQWDRD-MAZPMHBLSA-N
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Source of Spectrum AF-57-4084-12a

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Wiley Registry of Mass Spectral Data 2023

Author: Wiley

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