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(2E)-1,3-bis(3-Hydroxyphenyl)-2-propen-1-one, bis(trifluoroacetate)

View entire compound with spectra: 1 NMR

(2E)-1,3-bis(3-Hydroxyphenyl)-2-propen-1-one, bis(trifluoroacetate)
SpectraBase Compound ID C9jepnQgAPB
InChI InChI=1S/C19H10F6O5/c20-18(21,22)16(27)29-13-5-1-3-11(9-13)7-8-15(26)12-4-2-6-14(10-12)30-17(28)19(23,24)25/h1-10H/b8-7+
InChIKey QYJUPZQIQZAVLO-BQYQJAHWSA-N
Mol Weight 432.27 g/mol
Molecular Formula C19H10F6O5
Exact Mass 432.043242 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5IoHUHom9yq
Name (2E)-1,3-bis(3-Hydroxyphenyl)-2-propen-1-one, bis(trifluoroacetate)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 432.043242395 u
Formula C19H10F6O5
InChI InChI=1S/C19H10F6O5/c20-18(21,22)16(27)29-13-5-1-3-11(9-13)7-8-15(26)12-4-2-6-14(10-12)30-17(28)19(23,24)25/h1-10H/b8-7+
InChIKey QYJUPZQIQZAVLO-BQYQJAHWSA-N
Molecular Weight 432.274 g/mol
SMILES C1(OC(C(F)(F)F)=O)=CC(=CC=C1)\C=C\C(=O)C1=CC(=CC=C1)OC(C(F)(F)F)=O