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cyclohexanecarbothioic acid, S-phenyl ester

View entire compound with spectra: 2 NMR, and 2 FTIR

cyclohexanecarbothioic acid, S-phenyl ester
SpectraBase Compound ID JmmiWtViKNS
InChI InChI=1S/C13H16OS/c14-13(11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h2,5-6,9-11H,1,3-4,7-8H2
InChIKey YDDAIPNDFFZIAR-UHFFFAOYSA-N
Mol Weight 220.33 g/mol
Molecular Formula C13H16OS
Exact Mass 220.092186 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 3imgyaUFERy
Name CYCLOHEXANECARBOTHIOIC ACID, S-PHENYL ESTER
Source of Sample J. J. TALLEY, GENERAL ELECTRIC COMPANY, SCHENECTADY, NEW YORK
Boiling Point 116-118C/0.15mm
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16OS
InChI InChI=1S/C13H16OS/c14-13(11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h2,5-6,9-11H,1,3-4,7-8H2
InChIKey YDDAIPNDFFZIAR-UHFFFAOYSA-N
Literature Reference SYNTHESIS 1981, 549 Abstract-Chemical Abstracts= 95, 186598(1981)
Melting Point 39-40C
Molecular Weight 220.330002
Technique FILM (CAST FROM CHCl3)