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3-Pentafluoropropionyloxybenzoic acid, 3-(trimethylsilyloxycarbonyl)phenyl ester
SpectraBase Compound ID 1kEwPs2M3lP
InChI InChI=1S/C20H17F5O6Si/c1-32(2,3)31-17(27)13-7-5-8-14(11-13)29-16(26)12-6-4-9-15(10-12)30-18(28)19(21,22)20(23,24)25/h4-11H,1-3H3
InChIKey ULMAVBPYARUFHC-UHFFFAOYSA-N
Mol Weight 476.43 g/mol
Molecular Formula C20H17F5O6Si
Exact Mass 476.071456 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6EwC6YEGGnG
Name 3-Pentafluoropropionyloxybenzoic acid, 3-(trimethylsilyloxycarbonyl)phenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 476.071455611 u
Formula C20H17F5O6Si
InChI InChI=1S/C20H17F5O6Si/c1-32(2,3)31-17(27)13-7-5-8-14(11-13)29-16(26)12-6-4-9-15(10-12)30-18(28)19(21,22)20(23,24)25/h4-11H,1-3H3
InChIKey ULMAVBPYARUFHC-UHFFFAOYSA-N
Molecular Weight 476.427 g/mol
SMILES C1=CC=C(C=C1C(=O)OC1=CC=CC(=C1)C(=O)O[Si](C)(C)C)OC(C(C(F)(F)F)(F)F)=O