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4-[(3,5-Dichloro-2-pyridinyl)oxy]phenyl 4-ethoxybenzenesulfonate

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

4-[(3,5-Dichloro-2-pyridinyl)oxy]phenyl 4-ethoxybenzenesulfonate
SpectraBase Compound ID J0hCnESasPF
InChI InChI=1S/C19H15Cl2NO5S/c1-2-25-14-7-9-17(10-8-14)28(23,24)27-16-5-3-15(4-6-16)26-19-18(21)11-13(20)12-22-19/h3-12H,2H2,1H3
InChIKey HLDFXJYOWYRVER-UHFFFAOYSA-N
Mol Weight 440.3 g/mol
Molecular Formula C19H15Cl2NO5S
Exact Mass 439.004799 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4PRa00sdy6p
Name 4-[(3,5-Dichloro-2-pyridinyl)oxy]phenyl 4-ethoxybenzenesulfonate
Comments Computed using HOSE algorithm
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Exact Mass 439.004799156 u
Formula C19H15Cl2NO5S
InChI InChI=1S/C19H15Cl2NO5S/c1-2-25-14-7-9-17(10-8-14)28(23,24)27-16-5-3-15(4-6-16)26-19-18(21)11-13(20)12-22-19/h3-12H,2H2,1H3
InChIKey HLDFXJYOWYRVER-UHFFFAOYSA-N
Molecular Weight 440.297 g/mol
SMILES CCOC=1C=CC(S(OC=2C=CC(OC=3N=CC(=CC3Cl)Cl)=CC2)(=O)=O)=CC1