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

View entire compound with spectra: 1 NMR, and 1 FTIR

1,3-Benzenediol, o-methoxyacetyl-o'-(2-trifluoromethylbenzoyl)-
SpectraBase Compound ID ImWxG1AIhYJ
InChI InChI=1S/C17H13F3O5/c1-23-10-15(21)24-11-5-4-6-12(9-11)25-16(22)13-7-2-3-8-14(13)17(18,19)20/h2-9H,10H2,1H3
InChIKey ODQMPGCAZGJZQC-UHFFFAOYSA-N
Mol Weight 354.28 g/mol
Molecular Formula C17H13F3O5
Exact Mass 354.071508 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GzW0QSE9paC
Name 1,3-Benzenediol, o-methoxyacetyl-o'-(2-trifluoromethylbenzoyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 354.071508003 u
Formula C17H13F3O5
InChI InChI=1S/C17H13F3O5/c1-23-10-15(21)24-11-5-4-6-12(9-11)25-16(22)13-7-2-3-8-14(13)17(18,19)20/h2-9H,10H2,1H3
InChIKey ODQMPGCAZGJZQC-UHFFFAOYSA-N
Molecular Weight 354.281 g/mol
SMILES C1(=CC(=CC=C1)OC(=O)C1=C(C=CC=C1)C(F)(F)F)OC(COC)=O