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5-Chloro-2-methoxyphenylethynylphosphonic acid monoethyl ester
SpectraBase Compound ID CNC4tFg78Xr
InChI InChI=1S/C9H12ClO4P/c1-3-14-15(11,12)9-6-7(10)4-5-8(9)13-2/h4-6H,3H2,1-2H3,(H,11,12)
InChIKey XGAUESOZKWBSGX-UHFFFAOYSA-N
Mol Weight 250.62 g/mol
Molecular Formula C9H12ClO4P
Exact Mass 250.016174 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JqJq1OTYXoh
Name 5-Chloro-2-methoxyphenylethynylphosphonic acid monoethyl ester
Alternate Name(s) Ethyl hydrogen (5-chloro-2-methoxyphenyl)phosphonate
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Formula C9H12ClO4P
InChI InChI=1S/C9H12ClO4P/c1-3-14-15(11,12)9-6-7(10)4-5-8(9)13-2/h4-6H,3H2,1-2H3,(H,11,12)
InChIKey XGAUESOZKWBSGX-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.200990232
Molecular Weight 250.618 g/mol
SMILES OP(c1c(ccc(c1)Cl)OC)(=O)OCC
SPLASH splash10-0006-9460000000-686bab534c4375ed29c3
Source of Spectrum CJC-27-1389-4a
Wiley ID 1772339