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2'-Hydroxy-2,3,4',6'-tetramethoxychalcone, pentafluoropropionate

View entire compound with spectra: 1 NMR

2'-Hydroxy-2,3,4',6'-tetramethoxychalcone, pentafluoropropionate
SpectraBase Compound ID DAle007376d
InChI InChI=1S/C22H19F5O7/c1-30-13-10-16(32-3)18(17(11-13)34-20(29)21(23,24)22(25,26)27)14(28)9-8-12-6-5-7-15(31-2)19(12)33-4/h5-11H,1-4H3/b9-8+
InChIKey ZTPSIHGWBVLLEZ-CMDGGOBGSA-N
Mol Weight 490.38 g/mol
Molecular Formula C22H19F5O7
Exact Mass 490.105094 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3CIptr5zxj7
Name 2'-Hydroxy-2,3,4',6'-tetramethoxychalcone, pentafluoropropionate
Comments Computed using HOSE algorithm
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Exact Mass 490.105093760 u
Formula C22H19F5O7
InChI InChI=1S/C22H19F5O7/c1-30-13-10-16(32-3)18(17(11-13)34-20(29)21(23,24)22(25,26)27)14(28)9-8-12-6-5-7-15(31-2)19(12)33-4/h5-11H,1-4H3/b9-8+
InChIKey ZTPSIHGWBVLLEZ-CMDGGOBGSA-N
Molecular Weight 490.379 g/mol
SMILES C1(=C(C=C(C=C1OC(C(C(F)(F)F)(F)F)=O)OC)OC)C(\C=C\C1=C(C(=CC=C1)OC)OC)=O