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Methyl 6-[Chloro(difluoro)methyl]-3-(4-chlorobutyl)-2-hydroxy-4-methylbenzoate
SpectraBase Compound ID 4UeHCEI37eL
InChI InChI=1S/C14H16Cl2F2O3/c1-8-7-10(14(16,17)18)11(13(20)21-2)12(19)9(8)5-3-4-6-15/h7,19H,3-6H2,1-2H3
InChIKey IAGHVAKKHQIFOG-UHFFFAOYSA-N
Mol Weight 341.18 g/mol
Molecular Formula C14H16Cl2F2O3
Exact Mass 340.044456 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KPXv6qxUt3C
Name Methyl 6-[Chloro(difluoro)methyl]-3-(4-chlorobutyl)-2-hydroxy-4-methylbenzoate
Alternate Name(s) Methyl 3-(4-chlorobutyl)-6-(chlorodifluoromethyl)-2-hydroxy-4-methylbenzoate
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Formula C14H16Cl2F2O3
InChI InChI=1S/C14H16Cl2F2O3/c1-8-7-10(14(16,17)18)11(13(20)21-2)12(19)9(8)5-3-4-6-15/h7,19H,3-6H2,1-2H3
InChIKey IAGHVAKKHQIFOG-UHFFFAOYSA-N
Molecular Weight 341.182 g/mol
SMILES Oc1c(C(=O)OC)c(cc(c1CCCCCl)C)C(F)(F)Cl
SPLASH splash10-00di-0091000000-4e967ba78595e3d1bbba
Source of Spectrum H-95-1046-3y
Wiley ID 1784327