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Phthalic acid, 4-chlorophenyl 3,5-difluorophenyl ester

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Phthalic acid, 4-chlorophenyl 3,5-difluorophenyl ester
SpectraBase Compound ID 3NwWAZVhR3Y
InChI InChI=1S/C20H11ClF2O4/c21-12-5-7-15(8-6-12)26-19(24)17-3-1-2-4-18(17)20(25)27-16-10-13(22)9-14(23)11-16/h1-11H
InChIKey XTVCHZDNCMMSRB-UHFFFAOYSA-N
Mol Weight 388.75 g/mol
Molecular Formula C20H11ClF2O4
Exact Mass 388.031393 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HoI46Lv8bKr
Name Phthalic acid, 4-chlorophenyl 3,5-difluorophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 388.031392856 u
Formula C20H11ClF2O4
InChI InChI=1S/C20H11ClF2O4/c21-12-5-7-15(8-6-12)26-19(24)17-3-1-2-4-18(17)20(25)27-16-10-13(22)9-14(23)11-16/h1-11H
InChIKey XTVCHZDNCMMSRB-UHFFFAOYSA-N
Molecular Weight 388.754 g/mol
SMILES C1(=C(C=CC=C1)C(OC1=CC=C(C=C1)Cl)=O)C(OC1=CC(=CC(=C1)F)F)=O