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Methyl Sodium ethyl-.alpha.-[(2',4'-dichlorophenoxy)acetoxy]-(p-methylphenyl)-phosphonate
SpectraBase Compound ID KBWlMO4Z460
InChI InChI=1S/C18H19Cl2O6P.Na/c1-3-25-27(22,23)18(13-6-4-5-12(2)9-13)26-17(21)11-24-16-8-7-14(19)10-15(16)20;/h4-10,18H,3,11H2,1-2H3,(H,22,23);/q;+1/p-1
InChIKey CJGPTFSXSPHZKL-UHFFFAOYSA-M
Mol Weight 455.21 g/mol
Molecular Formula C18H18Cl2NaO6P
Exact Mass 454.011575 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HqPw8UxQMhY
Name Methyl Sodium ethyl-.alpha.-[(2',4'-dichlorophenoxy)acetoxy]-(p-methylphenyl)-phosphonate
Alternate Name(s) sodium ethyl {[(2,4-dichlorophenoxy)acetyl]oxy}(3-methylphenyl)methylphosphonate
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Formula C18H18Cl2NaO6P
InChI InChI=1S/C18H19Cl2O6P.Na/c1-3-25-27(22,23)18(13-6-4-5-12(2)9-13)26-17(21)11-24-16-8-7-14(19)10-15(16)20;/h4-10,18H,3,11H2,1-2H3,(H,22,23);/q;+1/p-1
InChIKey CJGPTFSXSPHZKL-UHFFFAOYSA-M
Molecular Weight 455.206 g/mol
SMILES [Na+].C(P([O-])(=O)OCC)(OC(=O)COc1c(cc(cc1)Cl)Cl)c1cc(C)ccc1
SPLASH splash10-004i-4900000000-2f25ab862874b299edf7
Source of Spectrum MZ-34-1422-6
Wiley ID 1582213