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Butylphosphonic acid, 2-isopropylphenyl nonyl ester

View entire compound with spectra: 1 NMR

Butylphosphonic acid, 2-isopropylphenyl nonyl ester
SpectraBase Compound ID 5Sqlb2mWcSS
InChI InChI=1S/C22H39O3P/c1-5-7-9-10-11-12-15-18-24-26(23,19-8-6-2)25-22-17-14-13-16-21(22)20(3)4/h13-14,16-17,20H,5-12,15,18-19H2,1-4H3
InChIKey FIGGVAPYPBTPTF-UHFFFAOYSA-N
Mol Weight 382.5 g/mol
Molecular Formula C22H39O3P
Exact Mass 382.263682 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6vvLIEbMPwa
Name Butylphosphonic acid, 2-isopropylphenyl nonyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 382.263682111 u
Formula C22H39O3P
InChI InChI=1S/C22H39O3P/c1-5-7-9-10-11-12-15-18-24-26(23,19-8-6-2)25-22-17-14-13-16-21(22)20(3)4/h13-14,16-17,20H,5-12,15,18-19H2,1-4H3
InChIKey FIGGVAPYPBTPTF-UHFFFAOYSA-N
Molecular Weight 382.525 g/mol
SMILES CCCCCCCCCOP(OC1=CC=CC=C1C(C)C)(CCCC)=O