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Butylphosphonic acid, hexadecyl 4-methoxy-2-methylbutyl ester

View entire compound with spectra: 1 NMR

Butylphosphonic acid, hexadecyl 4-methoxy-2-methylbutyl ester
SpectraBase Compound ID E4txTgbwWFy
InChI InChI=1S/C26H55O4P/c1-5-7-9-10-11-12-13-14-15-16-17-18-19-20-22-29-31(27,24-8-6-2)30-25-26(3)21-23-28-4/h26H,5-25H2,1-4H3
InChIKey NDTWGGQBVPWINN-UHFFFAOYSA-N
Mol Weight 462.7 g/mol
Molecular Formula C26H55O4P
Exact Mass 462.383797 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GK7kg9Vuo4J
Name Butylphosphonic acid, hexadecyl 4-methoxy-2-methylbutyl ester
Comments Computed using HOSE algorithm
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Exact Mass 462.383797245 u
Formula C26H55O4P
InChI InChI=1S/C26H55O4P/c1-5-7-9-10-11-12-13-14-15-16-17-18-19-20-22-29-31(27,24-8-6-2)30-25-26(3)21-23-28-4/h26H,5-25H2,1-4H3
InChIKey NDTWGGQBVPWINN-UHFFFAOYSA-N
Molecular Weight 462.696 g/mol
SMILES C(CCCOP(CCCC)(=O)OCC(CCOC)C)CCCCCCCCCCCC