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{alpha-[(p-chlorophenyl)thio]-o-toluoyl}carbamic acid, p-(methylthio)phenyl ester
SpectraBase Compound ID SmOeZ52fSP
InChI InChI=1S/C22H18ClNO3S2/c1-28-18-12-8-17(9-13-18)27-22(26)24-21(25)20-5-3-2-4-15(20)14-29-19-10-6-16(23)7-11-19/h2-13H,14H2,1H3,(H,24,25,26)
InChIKey NVNGMCICUOXGGN-UHFFFAOYSA-N
Mol Weight 443.96 g/mol
Molecular Formula C22H18ClNO3S2
Exact Mass 443.041663 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JS1GtQNKONs
Name {alpha-[(p-CHLOROPHENYL)THIO]-o-TOLUOYL}CARBAMIC ACID, p-(METHYLTHIO)PHENYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18ClNO3S2
InChI InChI=1S/C22H18ClNO3S2/c1-28-18-12-8-17(9-13-18)27-22(26)24-21(25)20-5-3-2-4-15(20)14-29-19-10-6-16(23)7-11-19/h2-13H,14H2,1H3,(H,24,25,26)
InChIKey NVNGMCICUOXGGN-UHFFFAOYSA-N
Melting Point 147C
Molecular Weight 443.97
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms CARBAMIC ACID, /A-//P-CHLOROPHENYL/THIO/-O-TOLUOYL/-, P-/METHYLTHIO/PHENYL ESTER