7-hydroxy-6-phenyl-5-thia-1-azabicyclo[4.2.0]octan-8-one, p-chlorobenzenesulfonate (ester)

SpectraBase Compound ID	20G8BAb5Dv6
InChI	InChI=1S/C18H16ClNO4S2/c19-14-7-9-15(10-8-14)26(22,23)24-16-17(21)20-11-4-12-25-18(16,20)13-5-2-1-3-6-13/h1-3,5-10,16H,4,11-12H2
InChIKey	XWGYCJHMBAJYCV-UHFFFAOYSA-N Google Search
Mol Weight	409.9 g/mol
Molecular Formula	C18H16ClNO4S2
Exact Mass	409.020928 g/mol

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SpectraBase Spectrum ID	5xBQI3EQk69
Name	7-HYDROXY-6-PHENYL-5-THIA-1-AZABICYCLO[4.2.0]OCTAN-8-ONE,p-CHLOROBENZENESULFONATE (ESTER)
Source of Sample	R. Lattrell, Hoechst AG, Frankfurt/Main, Germany
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C18H16ClNO4S2
InChI	InChI=1S/C18H16ClNO4S2/c19-14-7-9-15(10-8-14)26(22,23)24-16-17(21)20-11-4-12-25-18(16,20)13-5-2-1-3-6-13/h1-3,5-10,16H,4,11-12H2
InChIKey	XWGYCJHMBAJYCV-UHFFFAOYSA-N
Melting Point	138-139C
Molecular Weight	409.91
Solvent	Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms	5-THIA-1-AZABICYCLO/4.2.0/OCTAN- 8-ONE, 7-HYDROXY-6-PHENYL-, P-CHLOROBENZENESULFONATE (ESTER)