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Probencid trimethylsilyl ester
SpectraBase Compound ID J8mKuRRmN6N
InChI InChI=1S/C16H27NO4SSi/c1-6-12-17(13-7-2)22(19,20)15-10-8-14(9-11-15)16(18)21-23(3,4)5/h8-11H,6-7,12-13H2,1-5H3
InChIKey ZAWQWGRPDKSAMN-UHFFFAOYSA-N
Mol Weight 357.54 g/mol
Molecular Formula C16H27NO4SSi
Exact Mass 357.143006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID zc3069Euhx
Name Probencid trimethylsilyl ester
Comments Computed using HOSE algorithm
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Exact Mass 357.143006058 u
Formula C16H27NO4SSi
InChI InChI=1S/C16H27NO4SSi/c1-6-12-17(13-7-2)22(19,20)15-10-8-14(9-11-15)16(18)21-23(3,4)5/h8-11H,6-7,12-13H2,1-5H3
InChIKey ZAWQWGRPDKSAMN-UHFFFAOYSA-N
Molecular Weight 357.540 g/mol
SMILES C1=C(C=CC(=C1)C(O[Si](C)(C)C)=O)S(N(CCC)CCC)(=O)=O