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Glutaric acid, 2,4,6-trichlorophenyl pentafluorophenyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2,4,6-trichlorophenyl pentafluorophenyl ester
SpectraBase Compound ID 1LXIBWTKbsE
InChI InChI=1S/C17H8Cl3F5O4/c18-6-4-7(19)16(8(20)5-6)28-9(26)2-1-3-10(27)29-17-14(24)12(22)11(21)13(23)15(17)25/h4-5H,1-3H2
InChIKey BJDNDTYCXGRKOX-UHFFFAOYSA-N
Mol Weight 477.6 g/mol
Molecular Formula C17H8Cl3F5O4
Exact Mass 475.940833 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9RsP2nc5O4O
Name Glutaric acid, 2,4,6-trichlorophenyl pentafluorophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 475.940832649 u
Formula C17H8Cl3F5O4
InChI InChI=1S/C17H8Cl3F5O4/c18-6-4-7(19)16(8(20)5-6)28-9(26)2-1-3-10(27)29-17-14(24)12(22)11(21)13(23)15(17)25/h4-5H,1-3H2
InChIKey BJDNDTYCXGRKOX-UHFFFAOYSA-N
Molecular Weight 477.598 g/mol
SMILES C(CCC(OC1=C(C=C(C=C1Cl)Cl)Cl)=O)C(OC1=C(C(=C(C(=C1F)F)F)F)F)=O