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Isobutyl (2,4,5-trichlorophenoxy)acetate
SpectraBase Compound ID 9RrhAC6oLsh
InChI InChI=1S/C12H13Cl3O3/c1-7(2)5-18-12(16)6-17-11-4-9(14)8(13)3-10(11)15/h3-4,7H,5-6H2,1-2H3
InChIKey KIIVFWSIMRWBKW-UHFFFAOYSA-N
Mol Weight 311.59 g/mol
Molecular Formula C12H13Cl3O3
Exact Mass 309.993027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Py3EfahlAU
Name Isobutyl (2,4,5-trichlorophenoxy)acetate
Alternate Name(s) 2,4,5-t, isobutyl ester 2,4,5-Trichlorophenoxyacetic acid isobutyl ester 2-(2,4,5-trichlorophenoxy)acetic acid 2-methylpropyl ester 2-(2,4,5-trichlorophenoxy)acetic acid isobutyl ester 2-Methylpropyl 2-(2,4,5-trichlorophenoxy)acetate 2-Methylpropyl 2-[2,4,5-tris(chloranyl)phenoxy]ethanoate Acetic acid, (2,4,5-trichlorophenoxy)-, 2-methylpropyl ester Acetic acid, (2,4,5-trichlorophenoxy)-, isobutyl ester Isobutyl 2,4,5-T isobutyl 2-(2,4,5-trichlorophenoxy)acetate CASWELL NO. 881S EINECS 225-580-4 EPA PESTICIDE CHEMICAL CODE 082062 HSDB 4495
CAS Registry Number 4938-72-1
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Formula C12H13Cl3O3
InChI InChI=1S/C12H13Cl3O3/c1-7(2)5-18-12(16)6-17-11-4-9(14)8(13)3-10(11)15/h3-4,7H,5-6H2,1-2H3
InChIKey KIIVFWSIMRWBKW-UHFFFAOYSA-N
Molecular Weight 311.592 g/mol
SMILES c1(c(cc(c(c1)Cl)OCC(=O)OCC(C)C)Cl)Cl
SPLASH splash10-0a4l-9320000000-c39ec0cecb3a7869e46a
Source of Spectrum W5-0-0-0
Wiley ID 1311080