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3,3,4,4-Tetraphenyl-1,2-oxathiolan-5-one 2-oxide

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3,3,4,4-Tetraphenyl-1,2-oxathiolan-5-one 2-oxide
SpectraBase Compound ID BgS1JAlyFaf
InChI InChI=1S/C27H20O3S/c28-25-26(21-13-5-1-6-14-21,22-15-7-2-8-16-22)27(31(29)30-25,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H
InChIKey CIFDPSYRKUSXHV-UHFFFAOYSA-N
Mol Weight 424.51 g/mol
Molecular Formula C27H20O3S
Exact Mass 424.113316 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1fvbeC7iFG1
Name 3,3,4,4-Tetraphenyl-1,2-oxathiolan-5-one-2-oxide
CAS Registry Number 71816-86-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H20O3S
InChI InChI=1S/C27H20O3S/c28-25-26(21-13-5-1-6-14-21,22-15-7-2-8-16-22)27(31(29)30-25,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H
InChIKey CIFDPSYRKUSXHV-UHFFFAOYSA-N
Literature Reference H. Kohn, P. Charumilino, S.H. Simonsen, J. Am. Chem. Soc. 101, 5431 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3