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1,2-Benzenediol, o-(3-phenylpropionyl)-o'-(2-trifluoromethylbenzoyl)-

View entire compound with spectra: 1 NMR

1,2-Benzenediol, o-(3-phenylpropionyl)-o'-(2-trifluoromethylbenzoyl)-
SpectraBase Compound ID FiN50ancQWl
InChI InChI=1S/C23H17F3O4/c24-23(25,26)18-11-5-4-10-17(18)22(28)30-20-13-7-6-12-19(20)29-21(27)15-14-16-8-2-1-3-9-16/h1-13H,14-15H2
InChIKey NVGLOEDNDHIELU-UHFFFAOYSA-N
Mol Weight 414.38 g/mol
Molecular Formula C23H17F3O4
Exact Mass 414.107894 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LhWbJHvXy66
Name 1,2-Benzenediol, o-(3-phenylpropionyl)-o'-(2-trifluoromethylbenzoyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 414.107893512 u
Formula C23H17F3O4
InChI InChI=1S/C23H17F3O4/c24-23(25,26)18-11-5-4-10-17(18)22(28)30-20-13-7-6-12-19(20)29-21(27)15-14-16-8-2-1-3-9-16/h1-13H,14-15H2
InChIKey NVGLOEDNDHIELU-UHFFFAOYSA-N
Molecular Weight 414.380 g/mol
SMILES C1(=CC=CC=C1OC(=O)C=1C(C(F)(F)F)=CC=CC1)OC(=O)CCC1=CC=CC=C1