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cis-1-Thia-2,6-diphenyl-4-cyclohexanone

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cis-1-Thia-2,6-diphenyl-4-cyclohexanone
SpectraBase Compound ID JmOaUhFhXyI
InChI InChI=1S/C17H16OS/c18-15-11-16(13-7-3-1-4-8-13)19-17(12-15)14-9-5-2-6-10-14/h1-10,16-17H,11-12H2/t16-,17-/m1/s1
InChIKey PPJHHCQGZVIWAR-IAGOWNOFSA-N
Mol Weight 268.37 g/mol
Molecular Formula C17H16OS
Exact Mass 268.092186 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FtAgJBl669T
Name trans-1-Thia-2,6-diphenyl-4-cyclohexanone
CAS Registry Number 18456-45-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H16OS
InChI InChI=1S/C17H16OS/c18-15-11-16(13-7-3-1-4-8-13)19-17(12-15)14-9-5-2-6-10-14/h1-10,16-17H,11-12H2/t16-,17-/m1/s1
InChIKey PPJHHCQGZVIWAR-IAGOWNOFSA-N
Instrument Name Varian XL-100
Literature Reference K. Ramalingam, K.D. Berlin, J. Org. Chem. 44, 471 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3