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Methyl 4-[(Diethylphosphonyl)-methyl]-3-iodobenzoate
SpectraBase Compound ID 2WpjPTPYX89
InChI InChI=1S/C13H18IO5P/c1-4-18-20(16,19-5-2)9-11-7-6-10(8-12(11)14)13(15)17-3/h6-8H,4-5,9H2,1-3H3
InChIKey LSYKJWPLJRVNRC-UHFFFAOYSA-N
Mol Weight 412.16 g/mol
Molecular Formula C13H18IO5P
Exact Mass 411.993656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8lHmCd5TNPy
Name Methyl 4-[(Diethylphosphonyl)-methyl]-3-iodobenzoate
Alternate Name(s) Methyl 4-((diethoxyphosphoryl)methyl)-3-iodobenzoate
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Formula C13H18IO5P
InChI InChI=1S/C13H18IO5P/c1-4-18-20(16,19-5-2)9-11-7-6-10(8-12(11)14)13(15)17-3/h6-8H,4-5,9H2,1-3H3
InChIKey LSYKJWPLJRVNRC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cmdc.200900214
Molecular Weight 412.160 g/mol
SMILES C(=O)(OC)c1cc(I)c(CP(OCC)(OCC)=O)cc1
SPLASH splash10-004i-0090000000-c8ca21c5d6b741e94a47
Source of Spectrum CMC-4-1630/SM13-23e
Wiley ID 1771532