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Butylphosphonic acid, 2-isopropylphenyl undecyl ester

View entire compound with spectra: 1 NMR

Butylphosphonic acid, 2-isopropylphenyl undecyl ester
SpectraBase Compound ID GhIJIHBwnVv
InChI InChI=1S/C24H43O3P/c1-5-7-9-10-11-12-13-14-17-20-26-28(25,21-8-6-2)27-24-19-16-15-18-23(24)22(3)4/h15-16,18-19,22H,5-14,17,20-21H2,1-4H3
InChIKey JISQZCUIXQEKHX-UHFFFAOYSA-N
Mol Weight 410.6 g/mol
Molecular Formula C24H43O3P
Exact Mass 410.294982 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fafv0rt63YC
Name Butylphosphonic acid, 2-isopropylphenyl undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 410.294982240 u
Formula C24H43O3P
InChI InChI=1S/C24H43O3P/c1-5-7-9-10-11-12-13-14-17-20-26-28(25,21-8-6-2)27-24-19-16-15-18-23(24)22(3)4/h15-16,18-19,22H,5-14,17,20-21H2,1-4H3
InChIKey JISQZCUIXQEKHX-UHFFFAOYSA-N
Molecular Weight 410.579 g/mol
SMILES C(COP(CCCC)(OC1=CC=CC=C1C(C)C)=O)CCCCCCCCC