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Octadecanoic acid, 2-(2,4,6-trichlorophenoxy)-, ethyl ester
SpectraBase Compound ID EQg429XtcfV
InChI InChI=1S/C26H41Cl3O3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(26(30)31-4-2)32-25-22(28)19-21(27)20-23(25)29/h19-20,24H,3-18H2,1-2H3
InChIKey QSOKIANBILEGAB-UHFFFAOYSA-N
Mol Weight 508.0 g/mol
Molecular Formula C26H41Cl3O3
Exact Mass 506.212128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2KmiyfNvXy0
Name Octadecanoic acid, 2-(2,4,6-trichlorophenoxy)-, ethyl ester
Alternate Name(s) Ethyl 2-(2,4,6-trichlorophenoxy)octadecanoate 2-(2,4,6-trichlorophenoxy)octadecanoic acid ethyl ester Ethyl 2-[2,4,6-tris(chloranyl)phenoxy]octadecanoate
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Formula C26H41Cl3O3
InChI InChI=1S/C26H41Cl3O3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(26(30)31-4-2)32-25-22(28)19-21(27)20-23(25)29/h19-20,24H,3-18H2,1-2H3
InChIKey QSOKIANBILEGAB-UHFFFAOYSA-N
Molecular Weight 507.970 g/mol
SMILES CCCCCCCCCCCCCCCCC(Oc1c(Cl)cc(Cl)cc1Cl)C(=O)OCC
SPLASH splash10-03di-9326010000-ae2ba3cd1300f2b54d44
Source of Spectrum JX-2015-4-985
Wiley ID 1726392