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1,8,9,10-Tetrachloropentacyclo[6.2.2.0(2,7).0(3,5).0(4,6)]dodeca-9-en-11,12-dione
SpectraBase Compound ID Et3mjkwp3JK
InChI InChI=1S/C12H6Cl4O2/c13-7-8(14)12(16)6-4-1-2(4)3(1)5(6)11(7,15)9(17)10(12)18/h1-6H/t1-,2+,3-,4+,5-,6+,11-,12+
InChIKey DQGFPSNNKASABY-URPGMRDHSA-N
Mol Weight 324.0 g/mol
Molecular Formula C12H6Cl4O2
Exact Mass 321.91219 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KcByR9POvnU
Name 1,8,9,10-Tetrachloropentacyclo[6.2.2.0(2,7).0(3,5).0(4,6)]dodeca-9-en-11,12-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H6Cl4O2
InChI InChI=1S/C12H6Cl4O2/c13-7-8(14)12(16)6-4-1-2(4)3(1)5(6)11(7,15)9(17)10(12)18/h1-6H/t1-,2+,3-,4+,5-,6+,11-,12+
InChIKey DQGFPSNNKASABY-URPGMRDHSA-N
Literature Reference DOI 10.1002/cber.19771101204
Molecular Weight 323.990 g/mol
SMILES [C@]12(C(=C([C@@](C(C2=O)=O)(Cl)[C@]2([C@]3([C@]4([C@]([C@@]34[H])([C@@]12[H])[H])[H])[H])[H])Cl)Cl)Cl
SPLASH splash10-0udi-9420000000-813e38c4bae3055079c3
Source of Spectrum K-110-3756-9a
Synonyms (3aR,4S,7R,7aS)-4,5,6,7-tetrachloro-2,3,3a,4,7,7a-hexahydro-1H-1,2,3-(epimethanetriyl)-4,7-ethanoindene-8,9-dione
Wiley ID 1794207