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Butylphosphonic acid, 2-isopropoxyphenyl undecyl ester

View entire compound with spectra: 1 NMR

Butylphosphonic acid, 2-isopropoxyphenyl undecyl ester
SpectraBase Compound ID LAM7W8GpwdM
InChI InChI=1S/C24H43O4P/c1-5-7-9-10-11-12-13-14-17-20-26-29(25,21-8-6-2)28-24-19-16-15-18-23(24)27-22(3)4/h15-16,18-19,22H,5-14,17,20-21H2,1-4H3
InChIKey YRMJTSKICBNXMT-UHFFFAOYSA-N
Mol Weight 426.6 g/mol
Molecular Formula C24H43O4P
Exact Mass 426.289897 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KLV0R2kh0Qp
Name Butylphosphonic acid, 2-isopropoxyphenyl undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 426.289896859 u
Formula C24H43O4P
InChI InChI=1S/C24H43O4P/c1-5-7-9-10-11-12-13-14-17-20-26-29(25,21-8-6-2)28-24-19-16-15-18-23(24)27-22(3)4/h15-16,18-19,22H,5-14,17,20-21H2,1-4H3
InChIKey YRMJTSKICBNXMT-UHFFFAOYSA-N
Molecular Weight 426.578 g/mol
SMILES CCCCCCCCCCCOP(OC1=CC=CC=C1OC(C)C)(CCCC)=O