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2-{{2-[(p-chlorophenyl)sulfonyl]ethyl}thio}ethanol, carbanilate
SpectraBase Compound ID n56fi0fFL0
InChI InChI=1S/C17H18ClNO4S2/c18-14-6-8-16(9-7-14)25(21,22)13-12-24-11-10-23-17(20)19-15-4-2-1-3-5-15/h1-9H,10-13H2,(H,19,20)
InChIKey PIWMCCNGHKACHX-UHFFFAOYSA-N
Mol Weight 399.91 g/mol
Molecular Formula C17H18ClNO4S2
Exact Mass 399.036578 g/mol

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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 56QmOwYSwOW
Name 2-{{2-[(p-CHLOROPHENYL)SULFONYL]ETHYL}THIO}ETHANOL, CARBANILATE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18ClNO4S2
InChI InChI=1S/C17H18ClNO4S2/c18-14-6-8-16(9-7-14)25(21,22)13-12-24-11-10-23-17(20)19-15-4-2-1-3-5-15/h1-9H,10-13H2,(H,19,20)
InChIKey PIWMCCNGHKACHX-UHFFFAOYSA-N
Melting Point 141-143C
Molecular Weight 399.92
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms ETHANOL, 2-//2-//P-CHLOROPHENYL/SULFONYL/ETHYL/THIO/-, CARBANILATE