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2-Hydroxy-4-methoxy-4'-methylbenzophenone, pentafluoropropionate

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2-Hydroxy-4-methoxy-4'-methylbenzophenone, pentafluoropropionate
SpectraBase Compound ID JUK22NB0ZRG
InChI InChI=1S/C18H13F5O4/c1-10-3-5-11(6-4-10)15(24)13-8-7-12(26-2)9-14(13)27-16(25)17(19,20)18(21,22)23/h3-9H,1-2H3
InChIKey XDHBZTWGPYAICA-UHFFFAOYSA-N
Mol Weight 388.29 g/mol
Molecular Formula C18H13F5O4
Exact Mass 388.0734 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cer6jtOSQDw
Name 2-Hydroxy-4-methoxy-4'-methylbenzophenone, pentafluoropropionate
Comments Computed using HOSE algorithm
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Exact Mass 388.073399710 u
Formula C18H13F5O4
InChI InChI=1S/C18H13F5O4/c1-10-3-5-11(6-4-10)15(24)13-8-7-12(26-2)9-14(13)27-16(25)17(19,20)18(21,22)23/h3-9H,1-2H3
InChIKey XDHBZTWGPYAICA-UHFFFAOYSA-N
Molecular Weight 388.290 g/mol
SMILES COC1=CC(=C(C=C1)C(=O)C1=CC=C(C=C1)C)OC(C(C(F)(F)F)(F)F)=O