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.alpha.,.alpha.-p-Xylenediphosphonic acid DTetraisopropyl ester
SpectraBase Compound ID HmY46JTFMqr
InChI InChI=1S/C20H36O6P2/c1-15(2)23-27(21,24-16(3)4)13-19-9-11-20(12-10-19)14-28(22,25-17(5)6)26-18(7)8/h9-12,15-18H,13-14H2,1-8H3
InChIKey MEAGHMWQNQPUCE-UHFFFAOYSA-N
Mol Weight 434.4 g/mol
Molecular Formula C20H36O6P2
Exact Mass 434.198713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 23QtesW4fDi
Name .alpha.,.alpha.-p-Xylenediphosphonic acid DTetraisopropyl ester
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Formula C20H36O6P2
InChI InChI=1S/C20H36O6P2/c1-15(2)23-27(21,24-16(3)4)13-19-9-11-20(12-10-19)14-28(22,25-17(5)6)26-18(7)8/h9-12,15-18H,13-14H2,1-8H3
InChIKey MEAGHMWQNQPUCE-UHFFFAOYSA-N
Molecular Weight 434.450 g/mol
SMILES CC(OP(=O)(Cc1ccc(CP(=O)(OC(C)C)OC(C)C)cc1)OC(C)C)C
SPLASH splash10-0f79-1982100000-d0bf17081714fdc2b9d5
Source of Spectrum JX-2015-4-419
Synonyms 1,4-Bis[di(propan-2-yloxy)phosphorylmethyl]benzene Tetraisopropyl (1,4-phenylenebis(methylene))bis(phosphonate) Tetrapropan-2-yl (benzene-1,4-diyldimethanediyl)bis(phosphonate)
Wiley ID 1725859