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Glutaric acid, 2,3-dichlorophenyl pentafluorophenyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2,3-dichlorophenyl pentafluorophenyl ester
SpectraBase Compound ID HxbtkajZSIE
InChI InChI=1S/C17H9Cl2F5O4/c18-7-3-1-4-8(11(7)19)27-9(25)5-2-6-10(26)28-17-15(23)13(21)12(20)14(22)16(17)24/h1,3-4H,2,5-6H2
InChIKey MVFHBRDVYGYACU-UHFFFAOYSA-N
Mol Weight 443.15 g/mol
Molecular Formula C17H9Cl2F5O4
Exact Mass 441.979805 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EbJkRpGFlAO
Name Glutaric acid, 2,3-dichlorophenyl pentafluorophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 441.979804981 u
Formula C17H9Cl2F5O4
InChI InChI=1S/C17H9Cl2F5O4/c18-7-3-1-4-8(11(7)19)27-9(25)5-2-6-10(26)28-17-15(23)13(21)12(20)14(22)16(17)24/h1,3-4H,2,5-6H2
InChIKey MVFHBRDVYGYACU-UHFFFAOYSA-N
Molecular Weight 443.153 g/mol
SMILES C(CCC(OC1=C(C(=CC=C1)Cl)Cl)=O)C(OC1=C(C(=C(C(=C1F)F)F)F)F)=O