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2-Tert-butyl-5-[(tert-butyldimethylsilanyl)phenylmethyl]-6-methyl[1,3]dioxan-4-one
SpectraBase Compound ID CD8N2bpltha
InChI InChI=1S/C13H22Si.C9H16O3/c1-13(2,3)14(4,5)11-12-9-7-6-8-10-12;1-6-5-7(10)12-8(11-6)9(2,3)4/h6-10H,11H2,1-5H3;6,8H,5H2,1-4H3
InChIKey HROPBCOBQPNONX-UHFFFAOYSA-N
Mol Weight 378.63 g/mol
Molecular Formula C22H38O3Si
Exact Mass 378.259022 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IHCmS5qCte3
Name 2-Tert-butyl-5-[(tert-butyldimethylsilanyl)phenylmethyl]-6-methyl[1,3]dioxan-4-one
Comments Computed using HOSE algorithm
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Exact Mass 378.259021616 u
Formula C22H38O3Si
InChI InChI=1S/C13H22Si.C9H16O3/c1-13(2,3)14(4,5)11-12-9-7-6-8-10-12;1-6-5-7(10)12-8(11-6)9(2,3)4/h6-10H,11H2,1-5H3;6,8H,5H2,1-4H3
InChIKey HROPBCOBQPNONX-UHFFFAOYSA-N
Molecular Weight 378.628 g/mol
Nominal Mass 378 u
SMILES C(c1ccccc1)[Si](C)(C(C)(C)C)C.C1C(OC(OC1=O)C(C)(C)C)C