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Butylphosphonic acid, isobutyl tetradecyl ester
SpectraBase Compound ID AXKP9pp1PKU
InChI InChI=1S/C22H47O3P/c1-5-7-9-10-11-12-13-14-15-16-17-18-19-24-26(23,20-8-6-2)25-21-22(3)4/h22H,5-21H2,1-4H3
InChIKey NYHBDZZIFQFZSR-UHFFFAOYSA-N
Mol Weight 390.6 g/mol
Molecular Formula C22H47O3P
Exact Mass 390.326282 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8MPAZsR3kTs
Name Butylphosphonic acid, isobutyl tetradecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 390.326282368 u
Formula C22H47O3P
InChI InChI=1S/C22H47O3P/c1-5-7-9-10-11-12-13-14-15-16-17-18-19-24-26(23,20-8-6-2)25-21-22(3)4/h22H,5-21H2,1-4H3
InChIKey NYHBDZZIFQFZSR-UHFFFAOYSA-N
Molecular Weight 390.589 g/mol
SMILES CCCCCCCCCCCCCCOP(CCCC)(=O)OCC(C)C