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2',5'-Dihydroxychalcone, bis(pentafluoropropionate)

View entire compound with spectra: 1 NMR

2',5'-Dihydroxychalcone, bis(pentafluoropropionate)
SpectraBase Compound ID AzoWULNEnWi
InChI InChI=1S/C21H10F10O5/c22-18(23,20(26,27)28)16(33)35-12-7-9-15(36-17(34)19(24,25)21(29,30)31)13(10-12)14(32)8-6-11-4-2-1-3-5-11/h1-10H/b8-6+
InChIKey ONPPJWRMVYUXQW-SOFGYWHQSA-N
Mol Weight 532.29 g/mol
Molecular Formula C21H10F10O5
Exact Mass 532.036855 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CenT8WIgmBI
Name 2',5'-Dihydroxychalcone, bis(pentafluoropropionate)
Comments Computed using HOSE algorithm
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Exact Mass 532.036855047 u
Formula C21H10F10O5
InChI InChI=1S/C21H10F10O5/c22-18(23,20(26,27)28)16(33)35-12-7-9-15(36-17(34)19(24,25)21(29,30)31)13(10-12)14(32)8-6-11-4-2-1-3-5-11/h1-10H/b8-6+
InChIKey ONPPJWRMVYUXQW-SOFGYWHQSA-N
Molecular Weight 532.290 g/mol
SMILES C1(=CC(=CC=C1OC(C(C(F)(F)F)(F)F)=O)OC(C(C(F)(F)F)(F)F)=O)C(\C=C\C1=CC=CC=C1)=O