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Glutaric acid, 2,3-dichlorophenyl 3-fluorophenyl ester
SpectraBase Compound ID KEW9CcHymZJ
InChI InChI=1S/C17H13Cl2FO4/c18-13-6-2-7-14(17(13)19)24-16(22)9-3-8-15(21)23-12-5-1-4-11(20)10-12/h1-2,4-7,10H,3,8-9H2
InChIKey VPNNHNJMYQCDPS-UHFFFAOYSA-N
Mol Weight 371.19 g/mol
Molecular Formula C17H13Cl2FO4
Exact Mass 370.017492 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3ekAIlULBwf
Name Glutaric acid, 2,3-dichlorophenyl 3-fluorophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 370.017492458 u
Formula C17H13Cl2FO4
InChI InChI=1S/C17H13Cl2FO4/c18-13-6-2-7-14(17(13)19)24-16(22)9-3-8-15(21)23-12-5-1-4-11(20)10-12/h1-2,4-7,10H,3,8-9H2
InChIKey VPNNHNJMYQCDPS-UHFFFAOYSA-N
Molecular Weight 371.191 g/mol
SMILES C(CCC(OC1=C(C(=CC=C1)Cl)Cl)=O)C(OC1=CC=CC(=C1)F)=O