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3a,4,5,6,7,7a-hexahydro-3,3a,5,6-tetrachloro-4,7-methanobenzo[b]thiophene, 1,1-dioxide
SpectraBase Compound ID 7X80L1tcJSL
InChI InChI=1S/C9H8Cl4O2S/c10-5-2-16(14,15)8-3-1-4(9(5,8)13)7(12)6(3)11/h2-4,6-8H,1H2
InChIKey IXIWIDBJYSXAID-UHFFFAOYSA-N
Mol Weight 322.0 g/mol
Molecular Formula C9H8Cl4O2S
Exact Mass 319.899911 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5oMn8IcLYue
Name 3a,4,5,6,7,7a-HEXAHYDRO-3,3a,5,6-TETRACHLORO-4,7-METHANOBENZO[b]-THIOPHENE, 1,1-DIOXIDE
Source of Sample H. Bluestone, Diamond Alkali Company, Painesville, Ohio
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8Cl4O2S
InChI InChI=1S/C9H8Cl4O2S/c10-5-2-16(14,15)8-3-1-4(9(5,8)13)7(12)6(3)11/h2-4,6-8H,1H2
InChIKey IXIWIDBJYSXAID-UHFFFAOYSA-N
Melting Point 179-180C
Molecular Weight 322.04
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 4,7-METHANOTHIANAPHTHENE, 3A,4,5,6,7,7A-HEXAHYDRO-3,3A,5,6-TETRACHLORO-, -1,1-DIOXIDE 4,7-METHANOBENZO/B/THIOPHENE, 3A,4,5,6,7,7A-HEXAHYDRO-3,3A,5,6-TETRACHLORO-, -1,1-DIOXIDE