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Butylphosphonic acid, 3,5-dimethylphenyl tetradecyl ester

View entire compound with spectra: 1 NMR

Butylphosphonic acid, 3,5-dimethylphenyl tetradecyl ester
SpectraBase Compound ID 4go6aGEEDxt
InChI InChI=1S/C26H47O3P/c1-5-7-9-10-11-12-13-14-15-16-17-18-19-28-30(27,20-8-6-2)29-26-22-24(3)21-25(4)23-26/h21-23H,5-20H2,1-4H3
InChIKey OZNLYCKZFWXVBR-UHFFFAOYSA-N
Mol Weight 438.6 g/mol
Molecular Formula C26H47O3P
Exact Mass 438.326282 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AnmtFXosxuJ
Name Butylphosphonic acid, 3,5-dimethylphenyl tetradecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 438.326282368 u
Formula C26H47O3P
InChI InChI=1S/C26H47O3P/c1-5-7-9-10-11-12-13-14-15-16-17-18-19-28-30(27,20-8-6-2)29-26-22-24(3)21-25(4)23-26/h21-23H,5-20H2,1-4H3
InChIKey OZNLYCKZFWXVBR-UHFFFAOYSA-N
Molecular Weight 438.633 g/mol
SMILES C(CCCCOP(CCCC)(=O)OC1=CC(=CC(=C1)C)C)CCCCCCCCC