John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=1IIN32IddEr

(accessed ).
1,3-DITHIA-5,6-BENZOCYCLOHEPTENE
SpectraBase Compound ID 1IIN32IddEr
InChI InChI=1S/C9H10S2/c1-2-4-9-6-11-7-10-5-8(9)3-1/h1-4H,5-7H2
InChIKey XKBZAEGUFRRDCW-UHFFFAOYSA-N
Mol Weight 182.3 g/mol
Molecular Formula C9H10S2
Exact Mass 182.022394 g/mol
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Solvent CS2 carbon disulphid
Copyright Copyright © 2002-2021 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Solvent CS2 carbon disulphid
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent THF-D8
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent THF-D8
Copyright Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum OL-2-1135-8
  • 1,5-Dihydro-2,4-benzodithiepin
  • 1,3-DITHIA-5,6-BENZCYCLOHEPTENE (CONFORMER 1)
  • 1,3-DITHIA-5,6-BENZCYCLOHEPTENE (CONFORMER 2)
Title Journal or Book Year
Proton and carbon-13 nuclear magnetic resonance studies of the conformational properties of seven-membered heterocycles. 2,4-Benzodithiepin and its derivatives Canadian Journal of Chemistry 1979
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