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1,2-Benzendiol, o-acetoxyacetyl-o'-(4-trifluoromethylbenzoyl)-

View entire compound with spectra: 1 NMR

1,2-Benzendiol, o-acetoxyacetyl-o'-(4-trifluoromethylbenzoyl)-
SpectraBase Compound ID 1siuBLyhpJA
InChI InChI=1S/C18H13F3O6/c1-11(22)25-10-16(23)26-14-4-2-3-5-15(14)27-17(24)12-6-8-13(9-7-12)18(19,20)21/h2-9H,10H2,1H3
InChIKey XOAAGTWQIDEMPJ-UHFFFAOYSA-N
Mol Weight 382.29 g/mol
Molecular Formula C18H13F3O6
Exact Mass 382.066423 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8FYKAeuWmSe
Name 1,2-Benzendiol, o-acetoxyacetyl-o'-(4-trifluoromethylbenzoyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 382.066422622 u
Formula C18H13F3O6
InChI InChI=1S/C18H13F3O6/c1-11(22)25-10-16(23)26-14-4-2-3-5-15(14)27-17(24)12-6-8-13(9-7-12)18(19,20)21/h2-9H,10H2,1H3
InChIKey XOAAGTWQIDEMPJ-UHFFFAOYSA-N
Molecular Weight 382.291 g/mol
SMILES C1(=CC=CC=C1OC(C1=CC=C(C=C1)C(F)(F)F)=O)OC(=O)COC(C)=O