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3,7,12-Tris(trimethylsilyl)oxycoprostane

View entire compound with spectra: 1 NMR

3,7,12-Tris(trimethylsilyl)oxycoprostane
SpectraBase Compound ID 8om2HCfTr8C
InChI InChI=1S/C36H72O3Si3/c1-25(2)16-15-17-26(3)29-18-19-30-34-31(24-33(36(29,30)5)39-42(12,13)14)35(4)21-20-28(37-40(6,7)8)22-27(35)23-32(34)38-41(9,10)11/h25-34H,15-24H2,1-14H3
InChIKey YKRYUGIYGGLKAS-UHFFFAOYSA-N
Mol Weight 637.2 g/mol
Molecular Formula C36H72O3Si3
Exact Mass 636.478926 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3EJnahuFfwS
Name 3,7,12-Tris(trimethylsilyl)oxycoprostane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 636.478925780 u
Formula C36H72O3Si3
InChI InChI=1S/C36H72O3Si3/c1-25(2)16-15-17-26(3)29-18-19-30-34-31(24-33(36(29,30)5)39-42(12,13)14)35(4)21-20-28(37-40(6,7)8)22-27(35)23-32(34)38-41(9,10)11/h25-34H,15-24H2,1-14H3
InChIKey YKRYUGIYGGLKAS-UHFFFAOYSA-N
Molecular Weight 637.224 g/mol
SMILES C1(O[Si](C)(C)C)C2(C(C3C(O[Si](C)(C)C)CC4CC(O[Si](C)(C)C)CCC4(C3C1)C)CCC2C(CCCC(C)C)C)C