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3,7-DICHLORO-DIBENZOTHIOPHENE
SpectraBase Compound ID 1MxGbZoMqBE
InChI InChI=1S/C12H6Cl2S/c13-7-1-3-9-10-4-2-8(14)6-12(10)15-11(9)5-7/h1-6H
InChIKey XTWQFUXOEHUNBU-UHFFFAOYSA-N
Mol Weight 253.15 g/mol
Molecular Formula C12H6Cl2S
Exact Mass 251.956727 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2YwAMdc2bVC
Name 3,7-DICHLORO-DIBENZOTHIOPHENE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H6Cl2S
InChI InChI=1S/C12H6Cl2S/c13-7-1-3-9-10-4-2-8(14)6-12(10)15-11(9)5-7/h1-6H
InChIKey XTWQFUXOEHUNBU-UHFFFAOYSA-N
Literature Reference Author E.KOLEHMAINEN,J.KOIVISTO,V.NIKIFOROV,M.PERAEKYLAE,K.TUPPURAI NEN,K.LAIHIA,R.KAUPP
Literature Reference Citation MAGN.RES.CHEM.,37,743(1999)
Literature Reference DOI 10.1002/(sici)1097-458x(199910)37:10<743::aid-mrc532>3.0.co;2-z
Molecular Weight 253.146 g/mol
Solvent CDCl3
Source File Reference UWGE5003