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4'-Hydroxycannabidiol, tri-TMS ether

View entire compound with spectra: 1 MS (GC)

4'-Hydroxycannabidiol, tri-TMS ether
SpectraBase Compound ID GGCYhiPgE4J
InChI InChI=1S/C30H54O3Si3/c1-14-15-16-17-24-19-28(32-35(8,9)10)30(29(20-24)33-36(11,12)13)26-18-23(4)27(31-34(5,6)7)21-25(26)22(2)3/h18-20,25-27H,2,14-17,21H2,1,3-13H3/t25-,26+,27?/m0/s1
InChIKey SFYMPZYNQCCKHK-AJRFNQODSA-N
Mol Weight 547.0 g/mol
Molecular Formula C30H54O3Si3
Exact Mass 546.338075 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D0TphTecqDj
Name 4'-Hydroxycannabidiol, tri-TMS ether
Alternate Name(s) Tris (trimethyl silyl) ether of 4''-hydroxy cannabidiol Tris(trimethyl silyl) ether of 4''-Hydroxy cannabidiol {2-{(1R,6R)-6-isopropenyl-3-methyl-4-[(trimethylsilyl)oxy]-2-cyclohexen-1-yl}-5-pentyl-3-[(trimethylsilyl)oxy]phenoxy}(trimethyl)silane
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Formula C30H54O3Si3
InChI InChI=1S/C30H54O3Si3/c1-14-15-16-17-24-19-28(32-35(8,9)10)30(29(20-24)33-36(11,12)13)26-18-23(4)27(31-34(5,6)7)21-25(26)22(2)3/h18-20,25-27H,2,14-17,21H2,1,3-13H3/t25-,26+,27?/m0/s1
InChIKey SFYMPZYNQCCKHK-AJRFNQODSA-N
Molecular Weight 547.014 g/mol
SMILES [C@]1(c2c(O[Si](C)(C)C)cc(cc2O[Si](C)(C)C)CCCCC)(C=C(C)C(C[C@]1(C(=C)C)[H])O[Si](C)(C)C)[H]
SPLASH splash10-004i-4000910000-4b6465dc346d33273a6d
Source of Spectrum KO-2-268-3
Wiley ID 1405262