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2'-(Heptafluorobutyryl)oxy-2,4,5,5'-tetramethoxychalcone

View entire compound with spectra: 1 NMR

2'-(Heptafluorobutyryl)oxy-2,4,5,5'-tetramethoxychalcone
SpectraBase Compound ID BNBXSWKoask
InChI InChI=1S/C23H19F7O7/c1-33-13-6-8-16(37-20(32)21(24,25)22(26,27)23(28,29)30)14(10-13)15(31)7-5-12-9-18(35-3)19(36-4)11-17(12)34-2/h5-11H,1-4H3/b7-5+
InChIKey GMTZVDYGBDHLEU-FNORWQNLSA-N
Mol Weight 540.39 g/mol
Molecular Formula C23H19F7O7
Exact Mass 540.1019 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LrGCZT3xppJ
Name 2'-(Heptafluorobutyryl)oxy-2,4,5,5'-tetramethoxychalcone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 540.101900086 u
Formula C23H19F7O7
InChI InChI=1S/C23H19F7O7/c1-33-13-6-8-16(37-20(32)21(24,25)22(26,27)23(28,29)30)14(10-13)15(31)7-5-12-9-18(35-3)19(36-4)11-17(12)34-2/h5-11H,1-4H3/b7-5+
InChIKey GMTZVDYGBDHLEU-FNORWQNLSA-N
Molecular Weight 540.387 g/mol
SMILES C1(=CC(=CC=C1OC(=O)C(C(C(F)(F)F)(F)F)(F)F)OC)C(\C=C\C1=CC(=C(C=C1OC)OC)OC)=O