For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Phenoxathiin, 10,10-dioxide

View entire compound with spectra: 2 NMR, 1 FTIR, and 2 MS (GC)

Phenoxathiin, 10,10-dioxide
SpectraBase Compound ID CrOHk4HAziC
InChI InChI=1S/C12H8O3S/c13-16(14)11-7-3-1-5-9(11)15-10-6-2-4-8-12(10)16/h1-8H
InChIKey XJLRCPYQIPAQCA-UHFFFAOYSA-N
Mol Weight 232.25 g/mol
Molecular Formula C12H8O3S
Exact Mass 232.019415 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IQi6yc5zfuy
Name PHENOXATHIIN, 10,10-DIOXIDE
Source of Sample H. Pownall, Baylor College of Medicine, Houston, Texas
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8O3S
InChI InChI=1S/C12H8O3S/c13-16(14)11-7-3-1-5-9(11)15-10-6-2-4-8-12(10)16/h1-8H
InChIKey XJLRCPYQIPAQCA-UHFFFAOYSA-N
Melting Point 145.8-146.5C
Molecular Weight 232.26
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms PHENOXATHIIN, 10,10-DIOXIDE