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

View entire compound with spectra: 1 NMR

Phthalic acid, 3,4-dichlorophenyl 3,5-difluorophenyl ester
SpectraBase Compound ID GkT5I6hwCLV
InChI InChI=1S/C20H10Cl2F2O4/c21-17-6-5-13(10-18(17)22)27-19(25)15-3-1-2-4-16(15)20(26)28-14-8-11(23)7-12(24)9-14/h1-10H
InChIKey HFMDQXJYLGRLNX-UHFFFAOYSA-N
Mol Weight 423.2 g/mol
Molecular Formula C20H10Cl2F2O4
Exact Mass 421.992421 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 63qzQOFKQxb
Name Phthalic acid, 3,4-dichlorophenyl 3,5-difluorophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 421.992420524 u
Formula C20H10Cl2F2O4
InChI InChI=1S/C20H10Cl2F2O4/c21-17-6-5-13(10-18(17)22)27-19(25)15-3-1-2-4-16(15)20(26)28-14-8-11(23)7-12(24)9-14/h1-10H
InChIKey HFMDQXJYLGRLNX-UHFFFAOYSA-N
Molecular Weight 423.199 g/mol
SMILES C1(=C(C=CC=C1)C(OC1=CC(=C(C=C1)Cl)Cl)=O)C(OC1=CC(=CC(=C1)F)F)=O