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D-Lactose, octakis(trimethylsilyl) ether, methyloxime (isomer 1)
SpectraBase Compound ID H5S8R8oSASk
InChI InChI=1S/C37H89NO11Si8/c1-39-38-26-29(44-52(8,9)10)33(46-54(14,15)16)32(31(45-53(11,12)13)28-41-51(5,6)7)43-37-36(49-57(23,24)25)35(48-56(20,21)22)34(47-55(17,18)19)30(42-37)27-40-50(2,3)4/h26,29-37H,27-28H2,1-25H3/b38-26-
InChIKey KNAZTEWBFRPMHZ-HBAMXUDRSA-N
Mol Weight 948.8 g/mol
Molecular Formula C37H89NO11Si8
Exact Mass 947.458975 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Eq7mtHTfrxT
Name D-Lactose, octakis(trimethylsilyl) ether, methyloxime (isomer 1)
Comments Computed using HOSE algorithm
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Exact Mass 947.458974959 u
Formula C37H89NO11Si8
InChI InChI=1S/C37H89NO11Si8/c1-39-38-26-29(44-52(8,9)10)33(46-54(14,15)16)32(31(45-53(11,12)13)28-41-51(5,6)7)43-37-36(49-57(23,24)25)35(48-56(20,21)22)34(47-55(17,18)19)30(42-37)27-40-50(2,3)4/h26,29-37H,27-28H2,1-25H3/b38-26-
InChIKey KNAZTEWBFRPMHZ-HBAMXUDRSA-N
Molecular Weight 948.795 g/mol
SMILES C1(C(C(C(OC1CO[Si](C)(C)C)OC(C(C(\C=N/OC)O[Si](C)(C)C)O[Si](C)(C)C)C(CO[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C