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2R-(PARA-METHYLPHENYL)-6C-PHENYL-THIAN-4-ONE-1-OXIDE

View entire compound with spectra: 2 NMR

2R-(PARA-METHYLPHENYL)-6C-PHENYL-THIAN-4-ONE-1-OXIDE
SpectraBase Compound ID 9I5ywSZwrCT
InChI InChI=1S/C18H18O2S/c1-13-7-9-15(10-8-13)18-12-16(19)11-17(21(18)20)14-5-3-2-4-6-14/h2-10,17-18H,11-12H2,1H3/t17-,18-,21?/m0/s1
InChIKey CKTCBPZAEODNSI-GAOSQQNJSA-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 7h2oD76tnnz
Name 2R-(PARA-METHYLPHENYL)-6C-PHENYL-THIAN-4-ONE-1-OXIDE
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H18O2S
InChI InChI=1S/C18H18O2S/c1-13-7-9-15(10-8-13)18-12-16(19)11-17(21(18)20)14-5-3-2-4-6-14/h2-10,17-18H,11-12H2,1H3/t17-,18-,21?/m0/s1
InChIKey CKTCBPZAEODNSI-GAOSQQNJSA-N
Literature Reference Author D.DEVANATHAN,K.PANDIARAJAN
Literature Reference Citation SPECTROSC.LETT.,42,147(2009)
Literature Reference DOI 10.1080/00387010902772153
Molecular Weight 298.400 g/mol
Sample ID 968899
Solvent DMSO-D6