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Butylphosphonic acid, isobutyl hexyl ester
SpectraBase Compound ID Nh8tmL2TVf
InChI InChI=1S/C14H31O3P/c1-5-7-9-10-11-16-18(15,12-8-6-2)17-13-14(3)4/h14H,5-13H2,1-4H3
InChIKey ABZWFFMWVQSXFL-UHFFFAOYSA-N
Mol Weight 278.37 g/mol
Molecular Formula C14H31O3P
Exact Mass 278.201082 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K8VO6YIYqeP
Name Butylphosphonic acid, isobutyl hexyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 278.201081853 u
Formula C14H31O3P
InChI InChI=1S/C14H31O3P/c1-5-7-9-10-11-16-18(15,12-8-6-2)17-13-14(3)4/h14H,5-13H2,1-4H3
InChIKey ABZWFFMWVQSXFL-UHFFFAOYSA-N
Molecular Weight 278.373 g/mol
SMILES CC(C)COP(CCCC)(=O)OCCCCCC