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2-BENZOTHIOPHEN-1(3H)-THIONE

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2-BENZOTHIOPHEN-1(3H)-THIONE
SpectraBase Compound ID 5eZbxg3hTza
InChI InChI=1S/C8H6S2/c9-8-7-4-2-1-3-6(7)5-10-8/h1-4H,5H2
InChIKey SUCYJIRIQQTBRB-UHFFFAOYSA-N
Mol Weight 166.26 g/mol
Molecular Formula C8H6S2
Exact Mass 165.991093 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 58wM7H2IkEK
Name 2-BENZOTHIOPHEN-1(3H)-THIONE
CAS Registry Number 933-64-2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H6S2
InChI InChI=1S/C8H6S2/c9-8-7-4-2-1-3-6(7)5-10-8/h1-4H,5H2
InChIKey SUCYJIRIQQTBRB-UHFFFAOYSA-N
Literature Reference Author T.GADE,M.STREEK,J.VOSZ
Literature Reference Citation CHEM.BER.,125,127(1992)
Literature Reference DOI 10.1002/cber.19921250122
Molecular Weight 166.256 g/mol
Solvent CDCl3
Source File Reference UWCS7593