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Glutaric acid, 2,4,6-trichlorophenyl 2,2,3,3,3-pentafluoropropyl ester

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Glutaric acid, 2,4,6-trichlorophenyl 2,2,3,3,3-pentafluoropropyl ester
SpectraBase Compound ID 8rbM2M4oytv
InChI InChI=1S/C14H10Cl3F5O4/c15-7-4-8(16)12(9(17)5-7)26-11(24)3-1-2-10(23)25-6-13(18,19)14(20,21)22/h4-5H,1-3,6H2
InChIKey QANVWSTXKUHZCG-UHFFFAOYSA-N
Mol Weight 443.58 g/mol
Molecular Formula C14H10Cl3F5O4
Exact Mass 441.956483 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D0JRsSaBq9z
Name Glutaric acid, 2,4,6-trichlorophenyl 2,2,3,3,3-pentafluoropropyl ester
Comments Computed using HOSE algorithm
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Exact Mass 441.956482713 u
Formula C14H10Cl3F5O4
InChI InChI=1S/C14H10Cl3F5O4/c15-7-4-8(16)12(9(17)5-7)26-11(24)3-1-2-10(23)25-6-13(18,19)14(20,21)22/h4-5H,1-3,6H2
InChIKey QANVWSTXKUHZCG-UHFFFAOYSA-N
Molecular Weight 443.581 g/mol
SMILES C(CCC(OC1=C(C=C(C=C1Cl)Cl)Cl)=O)C(OCC(C(F)(F)F)(F)F)=O