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Diethyl (4-cyanophenyl)phosphonate
SpectraBase Compound ID HrA117fB7WW
InChI InChI=1S/C11H14NO3P/c1-3-14-16(13,15-4-2)11-7-5-10(9-12)6-8-11/h5-8H,3-4H2,1-2H3
InChIKey OKBKKZGFMZJHJL-UHFFFAOYSA-N
Mol Weight 239.21 g/mol
Molecular Formula C11H14NO3P
Exact Mass 239.07113 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HeZrWJkwfni
Name Diethyl (4-cyanophenyl)phosphonate
Appearance Yellow oil
Carrier Gas Hydrogen
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Exact Mass 239.071130310 u
Formula C11H14NO3P
InChI InChI=1S/C11H14NO3P/c1-3-14-16(13,15-4-2)11-7-5-10(9-12)6-8-11/h5-8H,3-4H2,1-2H3
InChIKey OKBKKZGFMZJHJL-UHFFFAOYSA-N
Instrument Name Agilent 6890N GC-5975 MS
Ionization Type EI
Literature Reference DOI 10.1002/chem.201705326
Molecular Weight 239.211 g/mol
Quality 12
SMILES C1=CC(=CC=C1C#N)P(=O)(OCC)OCC
SPLASH splash10-00lr-0900000000-5de606487ac9b84c2074
Source of Spectrum QE-24-SM11-11-2 (DOI: 10.1002/chem.201705326)
Wiley ID 1901406