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

View entire compound with spectra: 1 NMR

Phthalic acid, 3,5-difluorophenyl 2-nitrophenyl ester
SpectraBase Compound ID 1aRmIDqMvGf
InChI InChI=1S/C20H11F2NO6/c21-12-9-13(22)11-14(10-12)28-19(24)15-5-1-2-6-16(15)20(25)29-18-8-4-3-7-17(18)23(26)27/h1-11H
InChIKey DSDLRLQZFXKAMT-UHFFFAOYSA-N
Mol Weight 399.31 g/mol
Molecular Formula C20H11F2NO6
Exact Mass 399.055443 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3tuEiwCBMxG
Name Phthalic acid, 3,5-difluorophenyl 2-nitrophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 399.055443398 u
Formula C20H11F2NO6
InChI InChI=1S/C20H11F2NO6/c21-12-9-13(22)11-14(10-12)28-19(24)15-5-1-2-6-16(15)20(25)29-18-8-4-3-7-17(18)23(26)27/h1-11H
InChIKey DSDLRLQZFXKAMT-UHFFFAOYSA-N
Molecular Weight 399.306 g/mol
SMILES C1(=C(C=CC=C1)C(OC1=CC(=CC(=C1)F)F)=O)C(OC1=CC=CC=C1N(=O)=O)=O