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3-([Benzyl(dimethyl)silyl]oxy)androstan-17-one
SpectraBase Compound ID DUeph1i5H7Q
InChI InChI=1S/C28H42O2Si/c1-27-16-14-22(30-31(3,4)19-20-8-6-5-7-9-20)18-21(27)10-11-23-24-12-13-26(29)28(24,2)17-15-25(23)27/h5-9,21-25H,10-19H2,1-4H3
InChIKey RZJGUBYBYUUYFY-UHFFFAOYSA-N
Mol Weight 438.7 g/mol
Molecular Formula C28H42O2Si
Exact Mass 438.295407 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5RGrOjlYKIy
Name 3-([Benzyl(dimethyl)silyl]oxy)androstan-17-one
Comments Computed using HOSE algorithm
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Exact Mass 438.295407125 u
Formula C28H42O2Si
InChI InChI=1S/C28H42O2Si/c1-27-16-14-22(30-31(3,4)19-20-8-6-5-7-9-20)18-21(27)10-11-23-24-12-13-26(29)28(24,2)17-15-25(23)27/h5-9,21-25H,10-19H2,1-4H3
InChIKey RZJGUBYBYUUYFY-UHFFFAOYSA-N
Molecular Weight 438.727 g/mol
SMILES CC12CCC(CC2CCC2C3CCC(C3(C)CCC12)=O)O[Si](C)(C)CC1=CC=CC=C1