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

*Links on SpectraBase are not permalinks.

Phenoxathiin, 10-oxide

View entire compound with spectra: 9 NMR, 2 FTIR, and 3 MS (GC)

Phenoxathiin, 10-oxide
SpectraBase Compound ID LPDmeRyHg1S
InChI InChI=1S/C12H8O2S/c13-15-11-7-3-1-5-9(11)14-10-6-2-4-8-12(10)15/h1-8H
InChIKey ZESLIAUQVGLCIA-UHFFFAOYSA-N
Mol Weight 216.25 g/mol
Molecular Formula C12H8O2S
Exact Mass 216.024501 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 BXfN6gcDKrw
Name Phenoxathiin-S-oxide
CAS Registry Number 948-44-7
Comments broad-band decoupling (BB)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H8O2S
InChI InChI=1S/C12H8O2S/c13-15-11-7-3-1-5-9(11)14-10-6-2-4-8-12(10)15/h1-8H
InChIKey ZESLIAUQVGLCIA-UHFFFAOYSA-N
Instrument Name SF = 100 MHz
Literature Reference J. Org. Chem. 45, 189 (1980).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3