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XITQFTQFRMDRMD-RJYLNQFNSA-N
SpectraBase Compound ID 2wFfb8r2SnD
InChI InChI=1S/C8H8Cl4/c9-7(10)3-1-4-6(2-5(3)7)8(4,11)12/h3-6H,1-2H2/t3-,4-,5+,6+
InChIKey XITQFTQFRMDRMD-RJYLNQFNSA-N
Mol Weight 246.0 g/mol
Molecular Formula C8H8Cl4
Exact Mass 243.938011 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HCneXqMsejU
Name Anti-4,4,8,8,-tetrachclorotricyclo[5.1.0.0(3,5)]octane
CAS Registry Number 50843-60-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8Cl4
InChI InChI=1S/C8H8Cl4/c9-7(10)3-1-4-6(2-5(3)7)8(4,11)12/h3-6H,1-2H2/t3-,4-,5+,6+
InChIKey XITQFTQFRMDRMD-RJYLNQFNSA-N
Molecular Weight 245.964 g/mol
SMILES C1([C@@]2(C[C@]3([H])[C@@](C3(Cl)Cl)(C[C@]12[H])[H])[H])(Cl)Cl
SPLASH splash10-0a4i-0910000000-1520a82defccf0739983
Source of Spectrum K-110-1573-0
Synonyms Tricyclo[5.1.0.0(3,5)]octane, 4,4,8,8-tetrachloro-, (1.alpha.,3.beta.,5.beta.,7.alpha.)- (1R,3R,5S,7S)-4,4,8,8-tetrachlorotricyclo[5.1.0.0(3,5)]octane 4,4,8,8-Tetrachloro-cis-transoid-cis-tricyclo[5.1.0.0(3,5)]octane
Wiley ID 1246422