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(3a.alpha.,4.beta.,7.beta.,7a.alpha.,8s)-4,5,6,7,8-Pentachloro-3a,4,7,7a-tetrahydro-4,7-methanoisobenzofuran-1,3-dione
SpectraBase Compound ID DS8RaFfiLmC
InChI InChI=1S/C9H3Cl5O3/c10-3-4(11)9(14)2-1(5(15)17-6(2)16)8(3,13)7(9)12/h1-2,7H/t1-,2+,7-,8+,9-
InChIKey SPNJRJLWYJXHLM-YAHJXHOHSA-N
Mol Weight 336.4 g/mol
Molecular Formula C9H3Cl5O3
Exact Mass 333.852482 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8BSeRuc8wOC
Name (3a.alpha.,4.beta.,7.beta.,7a.alpha.,8s)-4,5,6,7,8-Pentachloro-3a,4,7,7a-tetrahydro-4,7-methanoisobenzofuran-1,3-dione
Alternate Name(s) (1R,2R,6S,7S)-1,7,8,9,10-pentachloro-4-oxatricyclo[5.2.1.0(2,6)]dec-8-ene-3,5-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H3Cl5O3
InChI InChI=1S/C9H3Cl5O3/c10-3-4(11)9(14)2-1(5(15)17-6(2)16)8(3,13)7(9)12/h1-2,7H/t1-,2+,7-,8+,9-
InChIKey SPNJRJLWYJXHLM-YAHJXHOHSA-N
Molecular Weight 336.385 g/mol
SMILES [C@]12([C@]3([C@@](C(=O)OC3=O)([H])[C@]([C@]1(Cl)[H])(Cl)C(=C2Cl)Cl)[H])Cl
SPLASH splash10-000l-0090000000-0ed65128716c0ed32672
Source of Spectrum J-62-943-21
Wiley ID 1330517