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Diethyl alpha-cyanobenzylphosphonate
SpectraBase Compound ID 1coiw4ubVgS
InChI InChI=1S/C12H16NO3P/c1-3-15-17(14,16-4-2)12(10-13)11-8-6-5-7-9-11/h5-9,12H,3-4H2,1-2H3
InChIKey OOAAVAAUXUISIN-UHFFFAOYSA-N
Mol Weight 253.24 g/mol
Molecular Formula C12H16NO3P
Exact Mass 253.08678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ig2kOeOIS9B
Name 2-Diethoxyphosphoryl-2-phenyl-acetonitrile
Alternate Name(s) 2-Diethoxyphosphoryl-2-phenyl-ethanenitrile Diethyl cyano(phenyl)methylphosphonate
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Formula C12H16NO3P
InChI InChI=1S/C12H16NO3P/c1-3-15-17(14,16-4-2)12(10-13)11-8-6-5-7-9-11/h5-9,12H,3-4H2,1-2H3
InChIKey OOAAVAAUXUISIN-UHFFFAOYSA-N
Molecular Weight 253.238 g/mol
SMILES C(P(=O)(OCC)OCC)(C#N)c1ccccc1
SPLASH splash10-0aor-0900000000-c4439369ffb5ec5f6326
Source of Spectrum QB-18-997-6
Wiley ID 841904