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2'-Trifluoroacetyloxy-2,4,4',5,6'-pentamethoxychalcone

View entire compound with spectra: 1 NMR

2'-Trifluoroacetyloxy-2,4,4',5,6'-pentamethoxychalcone
SpectraBase Compound ID J9FigdaL38R
InChI InChI=1S/C22H21F3O8/c1-28-13-9-18(32-5)20(19(10-13)33-21(27)22(23,24)25)14(26)7-6-12-8-16(30-3)17(31-4)11-15(12)29-2/h6-11H,1-5H3/b7-6+
InChIKey CXZFGBNHNKMOOJ-VOTSOKGWSA-N
Mol Weight 470.4 g/mol
Molecular Formula C22H21F3O8
Exact Mass 470.118852 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6ZO5OuuiSHr
Name 2'-Trifluoroacetyloxy-2,4,4',5,6'-pentamethoxychalcone
Comments Computed using HOSE algorithm
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Exact Mass 470.118852117 u
Formula C22H21F3O8
InChI InChI=1S/C22H21F3O8/c1-28-13-9-18(32-5)20(19(10-13)33-21(27)22(23,24)25)14(26)7-6-12-8-16(30-3)17(31-4)11-15(12)29-2/h6-11H,1-5H3/b7-6+
InChIKey CXZFGBNHNKMOOJ-VOTSOKGWSA-N
Molecular Weight 470.397 g/mol
SMILES C1(=C(C=C(C=C1OC(C(F)(F)F)=O)OC)OC)C(\C=C\C1=CC(=C(C=C1OC)OC)OC)=O