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1,2-Benzenediol, o-(2,6-difluorobenzoyl)-o'-isobutoxycarbonyl-

View entire compound with spectra: 1 NMR

1,2-Benzenediol, o-(2,6-difluorobenzoyl)-o'-isobutoxycarbonyl-
SpectraBase Compound ID ASY5qBQJUzP
InChI InChI=1S/C18H16F2O5/c1-11(2)10-23-18(22)25-15-9-4-3-8-14(15)24-17(21)16-12(19)6-5-7-13(16)20/h3-9,11H,10H2,1-2H3
InChIKey CPQQNFPSYKEDOB-UHFFFAOYSA-N
Mol Weight 350.32 g/mol
Molecular Formula C18H16F2O5
Exact Mass 350.09658 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8UdECqmxDgy
Name 1,2-Benzenediol, o-(2,6-difluorobenzoyl)-o'-isobutoxycarbonyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 350.096579936 u
Formula C18H16F2O5
InChI InChI=1S/C18H16F2O5/c1-11(2)10-23-18(22)25-15-9-4-3-8-14(15)24-17(21)16-12(19)6-5-7-13(16)20/h3-9,11H,10H2,1-2H3
InChIKey CPQQNFPSYKEDOB-UHFFFAOYSA-N
Molecular Weight 350.318 g/mol
SMILES C1(=CC=CC=C1OC(=O)OCC(C)C)OC(=O)C1=C(C=CC=C1F)F