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2-{{2-[(p-chlorophenyl)sulfonyl]ethyl}thio}ethanol, 3,5-dichlorobenzoate

View entire compound with spectra: 3 NMR, and 1 FTIR

2-{{2-[(p-chlorophenyl)sulfonyl]ethyl}thio}ethanol, 3,5-dichlorobenzoate
SpectraBase Compound ID BgRRCWdopNw
InChI InChI=1S/C17H15Cl3O4S2/c18-13-1-3-16(4-2-13)26(22,23)8-7-25-6-5-24-17(21)12-9-14(19)11-15(20)10-12/h1-4,9-11H,5-8H2
InChIKey GRZHWGYIUZOAFY-UHFFFAOYSA-N
Mol Weight 453.78 g/mol
Molecular Formula C17H15Cl3O4S2
Exact Mass 451.947734 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AauuRAIocaO
Name 2-{{2-[(p-CHLOROPHENYL)SULFONYL]ETHYL}THIO}ETHANOL, 3,5-DICHLOROBENZOATE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15Cl3O4S2
InChI InChI=1S/C17H15Cl3O4S2/c18-13-1-3-16(4-2-13)26(22,23)8-7-25-6-5-24-17(21)12-9-14(19)11-15(20)10-12/h1-4,9-11H,5-8H2
InChIKey GRZHWGYIUZOAFY-UHFFFAOYSA-N
Melting Point 104.5-105.5C
Molecular Weight 453.79
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms ETHANOL, 2-//2-//P-CHLOROPHENYL/SULFONYL/ETHYL/THIO/-, 3,5-DICHLOROBENZOATE