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Didecyl isopropylphosphonate
SpectraBase Compound ID Es56bn2kmuc
InChI InChI=1S/C23H49O3P/c1-5-7-9-11-13-15-17-19-21-25-27(24,23(3)4)26-22-20-18-16-14-12-10-8-6-2/h23H,5-22H2,1-4H3
InChIKey ZYOPTUQCJARBGP-UHFFFAOYSA-N
Mol Weight 404.6 g/mol
Molecular Formula C23H49O3P
Exact Mass 404.341932 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AjB8saKPLO2
Name Didecyl isopropylphosphonate
Comments Computed using HOSE algorithm
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Exact Mass 404.341932433 u
Formula C23H49O3P
InChI InChI=1S/C23H49O3P/c1-5-7-9-11-13-15-17-19-21-25-27(24,23(3)4)26-22-20-18-16-14-12-10-8-6-2/h23H,5-22H2,1-4H3
InChIKey ZYOPTUQCJARBGP-UHFFFAOYSA-N
Molecular Weight 404.616 g/mol
SMILES C(OP(OCCCCCCCCCC)(C(C)C)=O)CCCCCCCCC