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

*Links on SpectraBase are not permalinks.

2,3-Dihydrobenzo[b] thiophene-2,3-dione

View entire compound with spectra: 6 NMR, 2 FTIR, and 1 MS (GC)

2,3-Dihydrobenzo[b] thiophene-2,3-dione
SpectraBase Compound ID LXz5QbA51QG
InChI InChI=1S/C8H4O2S/c9-7-5-3-1-2-4-6(5)11-8(7)10/h1-4H
InChIKey MHESOLAAORBNPM-UHFFFAOYSA-N
Mol Weight 164.18 g/mol
Molecular Formula C8H4O2S
Exact Mass 163.993201 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 HOjNhUoAN2R
Name Thio-coumarandione
CAS Registry Number 493-57-2
Comments V.GALASSO,G.PELL
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H4O2S
InChI InChI=1S/C8H4O2S/c9-7-5-3-1-2-4-6(5)11-8(7)10/h1-4H
InChIKey MHESOLAAORBNPM-UHFFFAOYSA-N
Instrument Name Bruker WP-80
Literature Reference V. Galasso, G. Pellizer, G.C. Pappalardo, Org. Magn. Resonance 13, 228 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3