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6,6,7,7-TETRACHLORO-1-OCTYLBENZOATE
SpectraBase Compound ID 6EYwNQpdplH
InChI InChI=1S/C15H18Cl4O2/c1-14(16,17)15(18,19)10-6-3-7-11-21-13(20)12-8-4-2-5-9-12/h2,4-5,8-9H,3,6-7,10-11H2,1H3
InChIKey ALPHDIOMGFHWTN-UHFFFAOYSA-N
Mol Weight 372.1 g/mol
Molecular Formula C15H18Cl4O2
Exact Mass 370.006091 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FuL7POFaC40
Name 6,6,7,7-tetrachlorooctyl benzoate
Alternate Name(s) 6,6,7,7-tetrakis(chloranyl)octyl benzoate benzoic acid 6,6,7,7-tetrachlorooctyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C15H18Cl4O2
InChI InChI=1S/C15H18Cl4O2/c1-14(16,17)15(18,19)10-6-3-7-11-21-13(20)12-8-4-2-5-9-12/h2,4-5,8-9H,3,6-7,10-11H2,1H3
InChIKey ALPHDIOMGFHWTN-UHFFFAOYSA-N
Molecular Weight 372.119 g/mol
SMILES C(C(Cl)(Cl)CCCCCOC(=O)c1ccccc1)(Cl)(Cl)C
SPLASH splash10-00di-0309000000-c08fdff7c2c294cd674d
Source of Spectrum C-116-8123-15
Wiley ID 1353981