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Phthalic acid, 2-chlorophenyl 3,5-difluorophenyl ester

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Phthalic acid, 2-chlorophenyl 3,5-difluorophenyl ester
SpectraBase Compound ID W9RRLtJ7Z0
InChI InChI=1S/C20H11ClF2O4/c21-17-7-3-4-8-18(17)27-20(25)16-6-2-1-5-15(16)19(24)26-14-10-12(22)9-13(23)11-14/h1-11H
InChIKey KHMQBRWQVSOZPG-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 9zQCDQJyzWw
Name Phthalic acid, 2-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/c21-17-7-3-4-8-18(17)27-20(25)16-6-2-1-5-15(16)19(24)26-14-10-12(22)9-13(23)11-14/h1-11H
InChIKey KHMQBRWQVSOZPG-UHFFFAOYSA-N
Molecular Weight 388.754 g/mol
SMILES C1(=C(C=CC=C1)C(OC1=CC(=CC(=C1)F)F)=O)C(OC1=CC=CC=C1Cl)=O