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Butylphosphonic acid, 3-methylphenyl octyl ester
SpectraBase Compound ID 7vFg2YitcF1
InChI InChI=1S/C19H33O3P/c1-4-6-8-9-10-11-15-21-23(20,16-7-5-2)22-19-14-12-13-18(3)17-19/h12-14,17H,4-11,15-16H2,1-3H3
InChIKey HNOZHXVRUUAZQI-UHFFFAOYSA-N
Mol Weight 340.4 g/mol
Molecular Formula C19H33O3P
Exact Mass 340.216732 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DdXEPkB9jnR
Name Butylphosphonic acid, 3-methylphenyl octyl ester
Comments Computed using HOSE algorithm
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Exact Mass 340.216731918 u
Formula C19H33O3P
InChI InChI=1S/C19H33O3P/c1-4-6-8-9-10-11-15-21-23(20,16-7-5-2)22-19-14-12-13-18(3)17-19/h12-14,17H,4-11,15-16H2,1-3H3
InChIKey HNOZHXVRUUAZQI-UHFFFAOYSA-N
Molecular Weight 340.444 g/mol
SMILES C1=C(C=C(C=C1)C)OP(CCCC)(OCCCCCCCC)=O