Benzo[<i>d</i>][1,3]oxathiole-2-thione

Although known for 120 years, the title compound has not been adequately characterised before. In this paper, it is fully characterised by <sup>1</sup>H and <sup>13</sup>C NMR and IR spectroscopy and its X-ray structure has been determined for the first time.

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Main Authors: R. Alan Aitken, David B. Cordes, Lauryne Cottineau, Aidan P. McKay
Format: Article
Language:English
Published: MDPI AG 2024-09-01
Series:Molbank
Subjects:
Online Access:https://www.mdpi.com/1422-8599/2024/4/M1891
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author R. Alan Aitken
David B. Cordes
Lauryne Cottineau
Aidan P. McKay
author_facet R. Alan Aitken
David B. Cordes
Lauryne Cottineau
Aidan P. McKay
author_sort R. Alan Aitken
collection DOAJ
description Although known for 120 years, the title compound has not been adequately characterised before. In this paper, it is fully characterised by <sup>1</sup>H and <sup>13</sup>C NMR and IR spectroscopy and its X-ray structure has been determined for the first time.
format Article
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institution Kabale University
issn 1422-8599
language English
publishDate 2024-09-01
publisher MDPI AG
record_format Article
series Molbank
spelling doaj-art-5474a98069a7417cbfc9d3da6a0a762c2024-12-27T14:42:10ZengMDPI AGMolbank1422-85992024-09-0120244M189110.3390/M1891Benzo[<i>d</i>][1,3]oxathiole-2-thioneR. Alan Aitken0David B. Cordes1Lauryne Cottineau2Aidan P. McKay3EaStCHEM School of Chemistry, University of St Andrews, North Haugh, St Andrews KY16 9ST, Fife, UKEaStCHEM School of Chemistry, University of St Andrews, North Haugh, St Andrews KY16 9ST, Fife, UKEaStCHEM School of Chemistry, University of St Andrews, North Haugh, St Andrews KY16 9ST, Fife, UKEaStCHEM School of Chemistry, University of St Andrews, North Haugh, St Andrews KY16 9ST, Fife, UKAlthough known for 120 years, the title compound has not been adequately characterised before. In this paper, it is fully characterised by <sup>1</sup>H and <sup>13</sup>C NMR and IR spectroscopy and its X-ray structure has been determined for the first time.https://www.mdpi.com/1422-8599/2024/4/M18911,3-benzoxathiole-2-thioneX-ray structureNMR spectra
spellingShingle R. Alan Aitken
David B. Cordes
Lauryne Cottineau
Aidan P. McKay
Benzo[<i>d</i>][1,3]oxathiole-2-thione
Molbank
1,3-benzoxathiole-2-thione
X-ray structure
NMR spectra
title Benzo[<i>d</i>][1,3]oxathiole-2-thione
title_full Benzo[<i>d</i>][1,3]oxathiole-2-thione
title_fullStr Benzo[<i>d</i>][1,3]oxathiole-2-thione
title_full_unstemmed Benzo[<i>d</i>][1,3]oxathiole-2-thione
title_short Benzo[<i>d</i>][1,3]oxathiole-2-thione
title_sort benzo i d i 1 3 oxathiole 2 thione
topic 1,3-benzoxathiole-2-thione
X-ray structure
NMR spectra
url https://www.mdpi.com/1422-8599/2024/4/M1891
work_keys_str_mv AT ralanaitken benzoidi13oxathiole2thione
AT davidbcordes benzoidi13oxathiole2thione
AT laurynecottineau benzoidi13oxathiole2thione
AT aidanpmckay benzoidi13oxathiole2thione