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(6aa,6ba,7aa,7ba,13aa,13ba,14aa,14ba)-6b,7a,13b,14a-tetrachloroeicosahydrobenzo-[1'',2'' :3,4;4 '',5 '' :3',4']dicyclobuta[1,2:1',2']dicyclooctene-7,14-dione
SpectraBase Compound ID LLU3RCAltV1
InChI InChI=1S/C22H28Cl4O2/c23-19-13-9-5-1-2-6-10-14(13)20(19,24)18(28)22(26)16-12-8-4-3-7-11-15(16)21(22,25)17(19)27/h13-16H,1-12H2/t13-,14+,15-,16+,19-,20+,21-,22+
InChIKey YSAVKPPQULFABE-VICCPWBVSA-N
Mol Weight 466.3 g/mol
Molecular Formula C22H28Cl4O2
Exact Mass 464.084341 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2mEX5aWPg07
Name (6aa,6ba,7aa,7ba,13aa,13ba,14aa,14ba)-6b,7a,13b,14a-tetrachloroeicosahydrobenzo-[1'',2'' :3,4;4 '',5 '' :3',4']dicyclobuta[1,2:1',2']dicyclooctene-7,14-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28Cl4O2
InChI InChI=1S/C22H28Cl4O2/c23-19-13-9-5-1-2-6-10-14(13)20(19,24)18(28)22(26)16-12-8-4-3-7-11-15(16)21(22,25)17(19)27/h13-16H,1-12H2/t13-,14+,15-,16+,19-,20+,21-,22+
InChIKey YSAVKPPQULFABE-VICCPWBVSA-N
Molecular Weight 466.276 g/mol
SMILES [C@]12([C@@](C(=O)[C@]3([C@@](C2=O)([C@@]2([C@]3(CCCCCC2)[H])[H])Cl)Cl)(Cl)[C@]2([C@@]1(CCCCCC2)[H])[H])Cl
SPLASH splash10-07cr-9300000000-bf314bf464ead4d7703c
Source of Spectrum U1-2011-977-5c
Wiley ID 1664993