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Glutaric acid, 2,4,6-trichlorophenyl 4-chlorobenzyl ester
SpectraBase Compound ID HlEIuHRUmig
InChI InChI=1S/C18H14Cl4O4/c19-12-6-4-11(5-7-12)10-25-16(23)2-1-3-17(24)26-18-14(21)8-13(20)9-15(18)22/h4-9H,1-3,10H2
InChIKey RODPXDOWDOTINO-UHFFFAOYSA-N
Mol Weight 436.1 g/mol
Molecular Formula C18H14Cl4O4
Exact Mass 433.96462 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 125VgpBJsj3
Name Glutaric acid, 2,4,6-trichlorophenyl 4-chlorobenzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 433.964619727 u
Formula C18H14Cl4O4
InChI InChI=1S/C18H14Cl4O4/c19-12-6-4-11(5-7-12)10-25-16(23)2-1-3-17(24)26-18-14(21)8-13(20)9-15(18)22/h4-9H,1-3,10H2
InChIKey RODPXDOWDOTINO-UHFFFAOYSA-N
Molecular Weight 436.118 g/mol
SMILES C(CCC(OC1=C(C=C(C=C1Cl)Cl)Cl)=O)C(OCC1=CC=C(C=C1)Cl)=O