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Glutaric acid, 2,4,6-trichlorophenyl 3-ethylphenyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2,4,6-trichlorophenyl 3-ethylphenyl ester
SpectraBase Compound ID 74BKx58gjky
InChI InChI=1S/C19H17Cl3O4/c1-2-12-5-3-6-14(9-12)25-17(23)7-4-8-18(24)26-19-15(21)10-13(20)11-16(19)22/h3,5-6,9-11H,2,4,7-8H2,1H3
InChIKey ZNSUBWMAUURVFI-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 8cIBfxshBEX
Name Glutaric acid, 2,4,6-trichlorophenyl 3-ethylphenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 414.019242123 u
Formula C19H17Cl3O4
InChI InChI=1S/C19H17Cl3O4/c1-2-12-5-3-6-14(9-12)25-17(23)7-4-8-18(24)26-19-15(21)10-13(20)11-16(19)22/h3,5-6,9-11H,2,4,7-8H2,1H3
InChIKey ZNSUBWMAUURVFI-UHFFFAOYSA-N
Molecular Weight 415.700 g/mol
SMILES C(CCC(OC1=C(C=C(C=C1Cl)Cl)Cl)=O)C(OC1=CC=CC(CC)=C1)=O