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1,3-Benzenediol, o-(3-bromobenzoyl)-o'-(2-fluorobenzoyl)-

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

1,3-Benzenediol, o-(3-bromobenzoyl)-o'-(2-fluorobenzoyl)-
SpectraBase Compound ID AksSrvXjrHc
InChI InChI=1S/C20H12BrFO4/c21-14-6-3-5-13(11-14)19(23)25-15-7-4-8-16(12-15)26-20(24)17-9-1-2-10-18(17)22/h1-12H
InChIKey MEHMKEHCVSXBGN-UHFFFAOYSA-N
Mol Weight 415.21 g/mol
Molecular Formula C20H12BrFO4
Exact Mass 413.9903 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4cMS5ZpZt0j
Name 1,3-Benzenediol, o-(3-bromobenzoyl)-o'-(2-fluorobenzoyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 413.990300025 u
Formula C20H12BrFO4
InChI InChI=1S/C20H12BrFO4/c21-14-6-3-5-13(11-14)19(23)25-15-7-4-8-16(12-15)26-20(24)17-9-1-2-10-18(17)22/h1-12H
InChIKey MEHMKEHCVSXBGN-UHFFFAOYSA-N
Molecular Weight 415.214 g/mol
SMILES C1(=CC(=CC=C1)OC(C1=CC=CC=C1F)=O)OC(=O)C1=CC(=CC=C1)Br