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2,4-Dimethoxy-4'-hydroxybenzophenone, pentafluoropropionate

View entire compound with spectra: 1 NMR, and 1 FTIR

2,4-Dimethoxy-4'-hydroxybenzophenone, pentafluoropropionate
SpectraBase Compound ID FjHyC9YUmnB
InChI InChI=1S/C18H13F5O5/c1-26-12-7-8-13(14(9-12)27-2)15(24)10-3-5-11(6-4-10)28-16(25)17(19,20)18(21,22)23/h3-9H,1-2H3
InChIKey APESXVZBKCAQOC-UHFFFAOYSA-N
Mol Weight 404.29 g/mol
Molecular Formula C18H13F5O5
Exact Mass 404.068314 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IMIRgSRt5op
Name 2,4-Dimethoxy-4'-hydroxybenzophenone, pentafluoropropionate
Comments Computed using HOSE algorithm
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Exact Mass 404.068314329 u
Formula C18H13F5O5
InChI InChI=1S/C18H13F5O5/c1-26-12-7-8-13(14(9-12)27-2)15(24)10-3-5-11(6-4-10)28-16(25)17(19,20)18(21,22)23/h3-9H,1-2H3
InChIKey APESXVZBKCAQOC-UHFFFAOYSA-N
Molecular Weight 404.289 g/mol
SMILES COC1=C(C=CC(=C1)OC)C(=O)C1=CC=C(C=C1)OC(C(C(F)(F)F)(F)F)=O