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Butylphosphonic acid, 4-methoxybenzyl octyl ester
SpectraBase Compound ID GCBWexlwDYm
InChI InChI=1S/C20H35O4P/c1-4-6-8-9-10-11-16-23-25(21,17-7-5-2)24-18-19-12-14-20(22-3)15-13-19/h12-15H,4-11,16-18H2,1-3H3
InChIKey UBOAGLOOZZKJRL-UHFFFAOYSA-N
Mol Weight 370.5 g/mol
Molecular Formula C20H35O4P
Exact Mass 370.227297 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8IxpdryWLQk
Name Butylphosphonic acid, 4-methoxybenzyl octyl ester
Comments Computed using HOSE algorithm
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Exact Mass 370.227296601 u
Formula C20H35O4P
InChI InChI=1S/C20H35O4P/c1-4-6-8-9-10-11-16-23-25(21,17-7-5-2)24-18-19-12-14-20(22-3)15-13-19/h12-15H,4-11,16-18H2,1-3H3
InChIKey UBOAGLOOZZKJRL-UHFFFAOYSA-N
Molecular Weight 370.470 g/mol
SMILES CCCCCCCCOP(CCCC)(=O)OCC1=CC=C(C=C1)OC