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Diethyl 4-butyryloxy-2-oxo-4-(4-fluorophenyl)butylphosphonate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Diethyl 4-butyryloxy-2-oxo-4-(4-fluorophenyl)butylphosphonate
SpectraBase Compound ID CI9w7yRC2H8
InChI InChI=1S/C18H26FO6P/c1-4-7-18(21)25-17(14-8-10-15(19)11-9-14)12-16(20)13-26(22,23-5-2)24-6-3/h8-11,17H,4-7,12-13H2,1-3H3
InChIKey AJECKUYEUMEQRP-UHFFFAOYSA-N
Mol Weight 388.37 g/mol
Molecular Formula C18H26FO6P
Exact Mass 388.145104 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KdZy2bfyOVE
Name Diethyl 4-butyryloxy-2-oxo-4-(4-fluorophenyl)butylphosphonate
Comments Computed using HOSE algorithm
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Exact Mass 388.145103712 u
Formula C18H26FO6P
InChI InChI=1S/C18H26FO6P/c1-4-7-18(21)25-17(14-8-10-15(19)11-9-14)12-16(20)13-26(22,23-5-2)24-6-3/h8-11,17H,4-7,12-13H2,1-3H3
InChIKey AJECKUYEUMEQRP-UHFFFAOYSA-N
Molecular Weight 388.372 g/mol
SMILES C(C(CC(C=1C=CC(=CC1)F)OC(=O)CCC)=O)P(OCC)(OCC)=O