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3-(p-Nitrobenzoyl)-1-(diethylphosphonyl)prop-1-ene
SpectraBase Compound ID 5HgaVp3xIdt
InChI InChI=1S/C14H18NO6P/c1-3-20-22(19,21-4-2)11-5-6-14(16)12-7-9-13(10-8-12)15(17)18/h5,7-11H,3-4,6H2,1-2H3/b11-5+
InChIKey SSZHXZNYVYXVSY-VZUCSPMQSA-N
Mol Weight 327.27 g/mol
Molecular Formula C14H18NO6P
Exact Mass 327.087174 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2SOqsg53nPA
Name 3-(p-Nitrobenzoyl)-1-(diethylphosphonyl)prop-1-ene
Comments Less than 3 mono-isotopic peaks
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Formula C14H18NO6P
InChI InChI=1S/C14H18NO6P/c1-3-20-22(19,21-4-2)11-5-6-14(16)12-7-9-13(10-8-12)15(17)18/h5,7-11H,3-4,6H2,1-2H3/b11-5+
InChIKey SSZHXZNYVYXVSY-VZUCSPMQSA-N
Molecular Weight 327.273 g/mol
SMILES c1(N(=O)=O)ccc(C(=O)C\C=C\P(=O)(OCC)OCC)cc1
SPLASH splash10-0udi-0900000000-3c1a13563f8803c231f1
Source of Spectrum OP-31-218-4
Synonyms diethyl (1E)-4-(4-nitrophenyl)-4-oxo-1-butenylphosphonate Diethyl 3-(p-nitrobenzoyl)propen-1-phosphonate
Wiley ID 1577774