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Butylphosphonic acid, 2-(2-methoxyethyl)hexyl hexadecyl ester

View entire compound with spectra: 1 NMR

Butylphosphonic acid, 2-(2-methoxyethyl)hexyl hexadecyl ester
SpectraBase Compound ID Ge7c2pFKuaX
InChI InChI=1S/C29H61O4P/c1-5-8-11-12-13-14-15-16-17-18-19-20-21-22-25-32-34(30,27-10-7-3)33-28-29(23-9-6-2)24-26-31-4/h29H,5-28H2,1-4H3
InChIKey VROSJLXCPWAPQJ-UHFFFAOYSA-N
Mol Weight 504.8 g/mol
Molecular Formula C29H61O4P
Exact Mass 504.430747 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5VGPFy8cdRr
Name Butylphosphonic acid, 2-(2-methoxyethyl)hexyl hexadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 504.430747438 u
Formula C29H61O4P
InChI InChI=1S/C29H61O4P/c1-5-8-11-12-13-14-15-16-17-18-19-20-21-22-25-32-34(30,27-10-7-3)33-28-29(23-9-6-2)24-26-31-4/h29H,5-28H2,1-4H3
InChIKey VROSJLXCPWAPQJ-UHFFFAOYSA-N
Molecular Weight 504.777 g/mol
SMILES CCCCCCCCCCCCCCCCOP(CCCC)(=O)OCC(CCCC)CCOC