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1,1-DICHLORO-3,3-BIS-(TRIFLUOROMETHYL)-5-METHYL-[3-H-2,1-BENZOXATHIOLE]

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1,1-DICHLORO-3,3-BIS-(TRIFLUOROMETHYL)-5-METHYL-[3-H-2,1-BENZOXATHIOLE]
SpectraBase Compound ID B5VfJZ2YLmU
InChI InChI=1S/C10H6Cl2F6OS/c1-5-2-3-7-6(4-5)8(9(13,14)15,10(16,17)18)19-20(7,11)12/h2-4H,1H3
InChIKey BRKARASIQSEVAZ-UHFFFAOYSA-N
Mol Weight 359.11 g/mol
Molecular Formula C10H6Cl2F6OS
Exact Mass 357.94206 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IEOS2yHKiM0
Name 1,1-Dichloro-3,3-bis(trifluoromethyl)-5-methyl-2,1(3H)-benzoxathiole
CAS Registry Number 71120-40-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H6Cl2F6OS
InChI InChI=1S/C10H6Cl2F6OS/c1-5-2-3-7-6(4-5)8(9(13,14)15,10(16,17)18)19-20(7,11)12/h2-4H,1H3
InChIKey BRKARASIQSEVAZ-UHFFFAOYSA-N
Literature Reference L.D. Martin, E.F. Perozzi, J.C.Martin, J. Am. Chem. Soc. 101, 3595 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD2Cl2