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3-METHYL-1-OXO-2-PHENYL-6-(4-CHLOROPHENYL)-TETRAHYDROTHIOPYRAN-4-ONE
SpectraBase Compound ID 2xuxhwbA9yp
InChI InChI=1S/C18H17ClO2S/c1-12-16(20)11-17(13-7-9-15(19)10-8-13)22(21)18(12)14-5-3-2-4-6-14/h2-10,12,17-18H,11H2,1H3/t12-,17+,18-,22?/m1/s1
InChIKey RYEWNIQIWYOIRV-DTWGQBHKSA-N
Mol Weight 332.85 g/mol
Molecular Formula C18H17ClO2S
Exact Mass 332.063779 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LaLL6grgit3
Name 3-METHYL-1-OXO-2-PHENYL-6-(4-CHLOROPHENYL)-TETRAHYDROTHIOPYRAN-4-ONE
Compound Number 4C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H17ClO2S
InChI InChI=1S/C18H17ClO2S/c1-12-16(20)11-17(13-7-9-15(19)10-8-13)22(21)18(12)14-5-3-2-4-6-14/h2-10,12,17-18H,11H2,1H3/t12-,17+,18-,22?/m1/s1
InChIKey RYEWNIQIWYOIRV-DTWGQBHKSA-N
Literature Reference Author V.PADMAVATHI,T.V.R.REDDY,K.A.REDDY,D.B.REDDY
Literature Reference Citation J.HETCYCL.CHEM.,40,149(2003)
Literature Reference DOI 10.1002/jhet.5570400120
Molecular Weight 332.845 g/mol
Solvent CDCl3
Source File Reference UWMS22335