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Butylphosphonic acid, 2-phenylethyl tetradecyl ester
SpectraBase Compound ID Ja4u6QS0iFQ
InChI InChI=1S/C26H47O3P/c1-3-5-7-8-9-10-11-12-13-14-15-19-23-28-30(27,25-6-4-2)29-24-22-26-20-17-16-18-21-26/h16-18,20-21H,3-15,19,22-25H2,1-2H3
InChIKey WTLGVZQYBSQRIE-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 SsDVA9rJeP
Name Butylphosphonic acid, 2-phenylethyl 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/c1-3-5-7-8-9-10-11-12-13-14-15-19-23-28-30(27,25-6-4-2)29-24-22-26-20-17-16-18-21-26/h16-18,20-21H,3-15,19,22-25H2,1-2H3
InChIKey WTLGVZQYBSQRIE-UHFFFAOYSA-N
Molecular Weight 438.633 g/mol
SMILES C(COP(CCCC)(=O)OCCC1=CC=CC=C1)CCCCCCCCCCCC