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4-(2,2,2-Trichloroacetoxymethyl)benzyl Trichloroacetate
SpectraBase Compound ID IGcbFKBUMIq
InChI InChI=1S/C12H8Cl6O4/c13-11(14,15)9(19)21-5-7-1-2-8(4-3-7)6-22-10(20)12(16,17)18/h1-4H,5-6H2
InChIKey BDIOSQBWEGIJEL-UHFFFAOYSA-N
Mol Weight 428.9 g/mol
Molecular Formula C12H8Cl6O4
Exact Mass 425.855375 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I6n4sykqzbk
Name 4-(2,2,2-Trichloroacetoxymethyl)benzyl Trichloroacetate
Alternate Name(s) 1,4-phenylenebis(methylene) bis(2,2,2-trichloroacetate)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8Cl6O4
InChI InChI=1S/C12H8Cl6O4/c13-11(14,15)9(19)21-5-7-1-2-8(4-3-7)6-22-10(20)12(16,17)18/h1-4H,5-6H2
InChIKey BDIOSQBWEGIJEL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ejic.200700115
Molecular Weight 428.910 g/mol
SMILES c1cc(ccc1COC(C(Cl)(Cl)Cl)=O)COC(C(Cl)(Cl)Cl)=O
SPLASH splash10-014i-3490000000-17318aa1019aa3cb7abe
Source of Spectrum U2-2007-2940-4
Wiley ID 1791137