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

View entire compound with spectra: 1 NMR

Glutaric acid, 2,4,6-trichlorophenyl 2-ethylphenyl ester
SpectraBase Compound ID 1GmbsZdIMYS
InChI InChI=1S/C19H17Cl3O4/c1-2-12-6-3-4-7-16(12)25-17(23)8-5-9-18(24)26-19-14(21)10-13(20)11-15(19)22/h3-4,6-7,10-11H,2,5,8-9H2,1H3
InChIKey MBHRKLRWVUXOBF-UHFFFAOYSA-N
Mol Weight 415.7 g/mol
Molecular Formula C19H17Cl3O4
Exact Mass 414.019242 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GZAALefinIx
Name Glutaric acid, 2,4,6-trichlorophenyl 2-ethylphenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 414.019242123 u
Formula C19H17Cl3O4
InChI InChI=1S/C19H17Cl3O4/c1-2-12-6-3-4-7-16(12)25-17(23)8-5-9-18(24)26-19-14(21)10-13(20)11-15(19)22/h3-4,6-7,10-11H,2,5,8-9H2,1H3
InChIKey MBHRKLRWVUXOBF-UHFFFAOYSA-N
Molecular Weight 415.700 g/mol
SMILES C(CCC(OC1=C(C=C(C=C1Cl)Cl)Cl)=O)C(OC=1C(CC)=CC=CC1)=O