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4-(Benzoyloxy)benzoic acid, tms
SpectraBase Compound ID I9cEtZUCrwQ
InChI InChI=1S/C17H18O4Si/c1-22(2,3)21-17(19)14-9-11-15(12-10-14)20-16(18)13-7-5-4-6-8-13/h4-12H,1-3H3
InChIKey BURZNWMRFXCHST-UHFFFAOYSA-N
Mol Weight 314.41 g/mol
Molecular Formula C17H18O4Si
Exact Mass 314.097436 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bq4T09iFm0X
Name 4-(Benzoyloxy)benzoic acid, tms
Comments Computed using HOSE algorithm
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Exact Mass 314.097435591 u
Formula C17H18O4Si
InChI InChI=1S/C17H18O4Si/c1-22(2,3)21-17(19)14-9-11-15(12-10-14)20-16(18)13-7-5-4-6-8-13/h4-12H,1-3H3
InChIKey BURZNWMRFXCHST-UHFFFAOYSA-N
Molecular Weight 314.412 g/mol
SMILES C(OC1=CC=C(C=C1)C(O[Si](C)(C)C)=O)(=O)C1=CC=CC=C1