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3,4-Dihydroxybenzophenone, bis(pentafluoropropionate)

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3,4-Dihydroxybenzophenone, bis(pentafluoropropionate)
SpectraBase Compound ID HqmjzuNObYA
InChI InChI=1S/C19H8F10O5/c20-16(21,18(24,25)26)14(31)33-11-7-6-10(13(30)9-4-2-1-3-5-9)8-12(11)34-15(32)17(22,23)19(27,28)29/h1-8H
InChIKey FGRNYAGMYJKTJB-UHFFFAOYSA-N
Mol Weight 506.25 g/mol
Molecular Formula C19H8F10O5
Exact Mass 506.021205 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FBr0bogQ9di
Name 3,4-Dihydroxybenzophenone, bis(pentafluoropropionate)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 506.021204983 u
Formula C19H8F10O5
InChI InChI=1S/C19H8F10O5/c20-16(21,18(24,25)26)14(31)33-11-7-6-10(13(30)9-4-2-1-3-5-9)8-12(11)34-15(32)17(22,23)19(27,28)29/h1-8H
InChIKey FGRNYAGMYJKTJB-UHFFFAOYSA-N
Molecular Weight 506.252 g/mol
SMILES C1(OC(C(C(F)(F)F)(F)F)=O)=C(C=CC(=C1)C(=O)C1=CC=CC=C1)OC(C(C(F)(F)F)(F)F)=O