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Butylphosphonic acid, 4-octyl propyl ester
SpectraBase Compound ID 3VZbLNHYlyT
InChI InChI=1S/C15H33O3P/c1-5-9-12-15(11-7-3)18-19(16,14-10-6-2)17-13-8-4/h15H,5-14H2,1-4H3
InChIKey LYPLNWVDFYRAHW-UHFFFAOYSA-N
Mol Weight 292.4 g/mol
Molecular Formula C15H33O3P
Exact Mass 292.216732 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DcODW27n19F
Name Butylphosphonic acid, 4-octyl propyl ester
Comments Computed using HOSE algorithm
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Exact Mass 292.216731918 u
Formula C15H33O3P
InChI InChI=1S/C15H33O3P/c1-5-9-12-15(11-7-3)18-19(16,14-10-6-2)17-13-8-4/h15H,5-14H2,1-4H3
InChIKey LYPLNWVDFYRAHW-UHFFFAOYSA-N
Molecular Weight 292.400 g/mol
SMILES C(OP(CCCC)(OCCC)=O)(CCC)CCCC