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Butylphosphonic acid, 4-octyl octyl ester
SpectraBase Compound ID HpSYDNfyojP
InChI InChI=1S/C20H43O3P/c1-5-9-12-13-14-15-18-22-24(21,19-11-7-3)23-20(16-8-4)17-10-6-2/h20H,5-19H2,1-4H3
InChIKey OXVSOQYBLLQJPX-UHFFFAOYSA-N
Mol Weight 362.5 g/mol
Molecular Formula C20H43O3P
Exact Mass 362.294982 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3iKfy7izzod
Name Butylphosphonic acid, 4-octyl octyl ester
Comments Computed using HOSE algorithm
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Exact Mass 362.294982240 u
Formula C20H43O3P
InChI InChI=1S/C20H43O3P/c1-5-9-12-13-14-15-18-22-24(21,19-11-7-3)23-20(16-8-4)17-10-6-2/h20H,5-19H2,1-4H3
InChIKey OXVSOQYBLLQJPX-UHFFFAOYSA-N
Molecular Weight 362.535 g/mol
SMILES C(CCCCCCOP(OC(CCC)CCCC)(CCCC)=O)C