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Butylphosphonic acid, 4-chlorophenyl nonyl ester
SpectraBase Compound ID JtaRxJFF6sf
InChI InChI=1S/C19H32ClO3P/c1-3-5-7-8-9-10-11-16-22-24(21,17-6-4-2)23-19-14-12-18(20)13-15-19/h12-15H,3-11,16-17H2,1-2H3
InChIKey DBPDRCWAADYBHT-UHFFFAOYSA-N
Mol Weight 374.9 g/mol
Molecular Formula C19H32ClO3P
Exact Mass 374.17776 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2jJBgNI2Eai
Name Butylphosphonic acid, 4-chlorophenyl nonyl ester
Comments Computed using HOSE algorithm
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Exact Mass 374.177759585 u
Formula C19H32ClO3P
InChI InChI=1S/C19H32ClO3P/c1-3-5-7-8-9-10-11-16-22-24(21,17-6-4-2)23-19-14-12-18(20)13-15-19/h12-15H,3-11,16-17H2,1-2H3
InChIKey DBPDRCWAADYBHT-UHFFFAOYSA-N
Molecular Weight 374.889 g/mol
SMILES CCCCCCCCCOP(CCCC)(=O)OC1=CC=C(C=C1)Cl