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7-Methylxanthine, bis(tert-butyldimethylsilyl) deriv.

View entire compound with spectra: 1 NMR

7-Methylxanthine, bis(tert-butyldimethylsilyl) deriv.
SpectraBase Compound ID KLOfcKRCy3M
InChI InChI=1S/C18H34N4O2Si2/c1-17(2,3)25(8,9)23-15-13-14(19-12-22(13)7)20-16(21-15)24-26(10,11)18(4,5)6/h12H,1-11H3
InChIKey LLRAAECYYFTAQQ-UHFFFAOYSA-N
Mol Weight 394.7 g/mol
Molecular Formula C18H34N4O2Si2
Exact Mass 394.222029 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GJBtlIshBsj
Name 7-Methylxanthine, bis(tert-butyldimethylsilyl) deriv.
Comments Computed using HOSE algorithm
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Exact Mass 394.222029419 u
Formula C18H34N4O2Si2
InChI InChI=1S/C18H34N4O2Si2/c1-17(2,3)25(8,9)23-15-13-14(19-12-22(13)7)20-16(21-15)24-26(10,11)18(4,5)6/h12H,1-11H3
InChIKey LLRAAECYYFTAQQ-UHFFFAOYSA-N
Molecular Weight 394.666 g/mol
SMILES C12=C(N=C(N=C2N=CN1C)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C