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Benzoylmalic acid, 2tms dervative
SpectraBase Compound ID CIOso3BAVEJ
InChI InChI=1S/C17H26O6Si2/c1-24(2,3)22-15(18)12-14(17(20)23-25(4,5)6)21-16(19)13-10-8-7-9-11-13/h7-11,14H,12H2,1-6H3/t14-/m0/s1
InChIKey IEAOYVAQMKNDPQ-AWEZNQCLSA-N
Mol Weight 382.56 g/mol
Molecular Formula C17H26O6Si2
Exact Mass 382.126792 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Epzj1sE1q8Z
Name Benzoylmalic acid, 2tms dervative
Comments Computed using HOSE algorithm
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Exact Mass 382.126791621 u
Formula C17H26O6Si2
InChI InChI=1S/C17H26O6Si2/c1-24(2,3)22-15(18)12-14(17(20)23-25(4,5)6)21-16(19)13-10-8-7-9-11-13/h7-11,14H,12H2,1-6H3/t14-/m0/s1
InChIKey IEAOYVAQMKNDPQ-AWEZNQCLSA-N
Molecular Weight 382.559 g/mol
SMILES C([C@](OC(=O)C1=CC=CC=C1)(C(O[Si](C)(C)C)=O)[H])C(=O)O[Si](C)(C)C