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1-(2,4-Dichlorophenyl)-2-(imidazol-1-yl)ethoxyacetic acid, ethyl ester

View entire compound with spectra: 1 NMR, and 3 MS (GC)

1-(2,4-Dichlorophenyl)-2-(imidazol-1-yl)ethoxyacetic acid, ethyl ester
SpectraBase Compound ID JtgMTvavtmA
InChI InChI=1S/C15H16Cl2N2O3/c1-2-21-15(20)9-22-14(8-19-6-5-18-10-19)12-4-3-11(16)7-13(12)17/h3-7,10,14H,2,8-9H2,1H3
InChIKey JEWYWBGWSRYAGP-UHFFFAOYSA-N
Mol Weight 343.21 g/mol
Molecular Formula C15H16Cl2N2O3
Exact Mass 342.053798 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID tQDtjlWOFg
Name 1-(2,4-Dichlorophenyl)-2-(imidazol-1-yl)ethoxyacetic acid, ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 342.053797780 u
Formula C15H16Cl2N2O3
InChI InChI=1S/C15H16Cl2N2O3/c1-2-21-15(20)9-22-14(8-19-6-5-18-10-19)12-4-3-11(16)7-13(12)17/h3-7,10,14H,2,8-9H2,1H3
InChIKey JEWYWBGWSRYAGP-UHFFFAOYSA-N
Molecular Weight 343.210 g/mol
SMILES C1(Cl)=CC=C(C(=C1)Cl)C(CN1C=CN=C1)OCC(OCC)=O