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Phthalic acid, 3,5-difluorophenyl 4-methoxyphenyl ester
SpectraBase Compound ID HpkPRPmfbh2
InChI InChI=1S/C21H14F2O5/c1-26-15-6-8-16(9-7-15)27-20(24)18-4-2-3-5-19(18)21(25)28-17-11-13(22)10-14(23)12-17/h2-12H,1H3
InChIKey RWFDIYARVVHTBF-UHFFFAOYSA-N
Mol Weight 384.33 g/mol
Molecular Formula C21H14F2O5
Exact Mass 384.08093 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID v6k77tArlc
Name Phthalic acid, 3,5-difluorophenyl 4-methoxyphenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 384.080929872 u
Formula C21H14F2O5
InChI InChI=1S/C21H14F2O5/c1-26-15-6-8-16(9-7-15)27-20(24)18-4-2-3-5-19(18)21(25)28-17-11-13(22)10-14(23)12-17/h2-12H,1H3
InChIKey RWFDIYARVVHTBF-UHFFFAOYSA-N
Molecular Weight 384.335 g/mol
SMILES C1(=C(C=CC=C1)C(OC1=CC=C(OC)C=C1)=O)C(OC1=CC(=CC(=C1)F)F)=O