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3-Bromo-4-[(4-chlorobenzoyl)oxy]phenyl 4-chlorobenzoate
SpectraBase Compound ID EMMXuAYn6db
InChI InChI=1S/C20H11BrCl2O4/c21-17-11-16(26-19(24)12-1-5-14(22)6-2-12)9-10-18(17)27-20(25)13-3-7-15(23)8-4-13/h1-11H
InChIKey NVEDYLWSBGFSFG-UHFFFAOYSA-N
Mol Weight 466.11 g/mol
Molecular Formula C20H11BrCl2O4
Exact Mass 463.921777 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1BHmdmOPnCd
Name 3-Bromo-4-[(4-chlorobenzoyl)oxy]phenyl 4-chlorobenzoate
Comments Computed using HOSE algorithm
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Exact Mass 463.921777230 u
Formula C20H11BrCl2O4
InChI InChI=1S/C20H11BrCl2O4/c21-17-11-16(26-19(24)12-1-5-14(22)6-2-12)9-10-18(17)27-20(25)13-3-7-15(23)8-4-13/h1-11H
InChIKey NVEDYLWSBGFSFG-UHFFFAOYSA-N
Molecular Weight 466.114 g/mol
SMILES C(OC=1C=CC(=CC1Br)OC(=O)C=1C=CC(=CC1)Cl)(=O)C=1C=CC(=CC1)Cl