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Dimethylacetylmethyl phosphonate
SpectraBase Compound ID AzzalMQmLlA
InChI InChI=1S/C5H11O6P/c1-5(6)10-4-11-12(7,8-2)9-3/h4H2,1-3H3
InChIKey GACYOQOYTPDQQJ-UHFFFAOYSA-N
Mol Weight 198.11 g/mol
Molecular Formula C5H11O6P
Exact Mass 198.029325 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2gvyAYVx2G6
Name Dimethylacetylmethyl phosphonate
Comments Computed using HOSE algorithm
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Exact Mass 198.029325066 u
Formula C5H11O6P
InChI InChI=1S/C5H11O6P/c1-5(6)10-4-11-12(7,8-2)9-3/h4H2,1-3H3
InChIKey GACYOQOYTPDQQJ-UHFFFAOYSA-N
Molecular Weight 198.111 g/mol
SMILES COP(OC)(=O)OCOC(C)=O