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3-METHYL-1-OXO-2,6-DIPHENYL-TETRAHYDROTHIOPYRAN-4-ONE
SpectraBase Compound ID 2PJ40Ui9hPU
InChI InChI=1S/C18H18O2S/c1-13-16(19)12-17(14-8-4-2-5-9-14)21(20)18(13)15-10-6-3-7-11-15/h2-11,13,17-18H,12H2,1H3/t13-,17+,18-,21?/m1/s1
InChIKey CGLYSSVKYTUYMX-QQAFBVJGSA-N
Mol Weight 298.4 g/mol
Molecular Formula C18H18O2S
Exact Mass 298.102751 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8esizWRploI
Name 3-METHYL-1-OXO-2,6-DIPHENYL-TETRAHYDROTHIOPYRAN-4-ONE
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H18O2S
InChI InChI=1S/C18H18O2S/c1-13-16(19)12-17(14-8-4-2-5-9-14)21(20)18(13)15-10-6-3-7-11-15/h2-11,13,17-18H,12H2,1H3/t13-,17+,18-,21?/m1/s1
InChIKey CGLYSSVKYTUYMX-QQAFBVJGSA-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 298.400 g/mol
Solvent CDCl3
Source File Reference UWMS22333