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2,3,4-Trihydroxybenzophenone, tris(trifluoroacetate)

View entire compound with spectra: 1 NMR

2,3,4-Trihydroxybenzophenone, tris(trifluoroacetate)
SpectraBase Compound ID GFnupYJ64Va
InChI InChI=1S/C19H7F9O7/c20-17(21,22)14(30)33-10-7-6-9(11(29)8-4-2-1-3-5-8)12(34-15(31)18(23,24)25)13(10)35-16(32)19(26,27)28/h1-7H
InChIKey QZNDUUODJXOHTM-UHFFFAOYSA-N
Mol Weight 518.24 g/mol
Molecular Formula C19H7F9O7
Exact Mass 518.004806 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C06cGYlZe0Q
Name 2,3,4-Trihydroxybenzophenone, tris(trifluoroacetate)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 518.004806025 u
Formula C19H7F9O7
InChI InChI=1S/C19H7F9O7/c20-17(21,22)14(30)33-10-7-6-9(11(29)8-4-2-1-3-5-8)12(34-15(31)18(23,24)25)13(10)35-16(32)19(26,27)28/h1-7H
InChIKey QZNDUUODJXOHTM-UHFFFAOYSA-N
Molecular Weight 518.244 g/mol
SMILES C1(OC(C(F)(F)F)=O)=C(C(=CC=C1OC(C(F)(F)F)=O)C(=O)C1=CC=CC=C1)OC(C(F)(F)F)=O