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Diethyl (1-butyl,1-ethyl-2-acetate)phosphonate
SpectraBase Compound ID 6H7LJzmiSQd
InChI InChI=1S/C12H25O5P/c1-5-9-10-11(12(13)15-6-2)18(14,16-7-3)17-8-4/h11H,5-10H2,1-4H3
InChIKey XFALQKGHLZQHIL-UHFFFAOYSA-N
Mol Weight 280.3 g/mol
Molecular Formula C12H25O5P
Exact Mass 280.143961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4H7U54r4IUE
Name Diethyl (1-butyl,1-ethyl-2-acetate)phosphonate
Alternate Name(s) Ethyl 2-(diethoxyphosphoryl)hexanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H25O5P
InChI InChI=1S/C12H25O5P/c1-5-9-10-11(12(13)15-6-2)18(14,16-7-3)17-8-4/h11H,5-10H2,1-4H3
InChIKey XFALQKGHLZQHIL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cctc.201801040
Molecular Weight 280.301 g/mol
SMILES CCCCC(C(=O)OCC)P(OCC)(OCC)=O
SPLASH splash10-0abi-4950000000-4a376d3168fd6a797224
Source of Spectrum CCC-10-SM9-3g
Wiley ID 1812751