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1-(p-Nitrobenzoyl)-3-(diethylphosphonyl)prop-1-ene
SpectraBase Compound ID 25rphDRxzg2
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/h5-10H,3-4,11H2,1-2H3/b6-5+
InChIKey RLVBJJRWQSPREM-AATRIKPKSA-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 7lMepFPJWa7
Name 1-(p-Nitrobenzoyl)-3-(diethylphosphonyl)prop-1-ene
Alternate Name(s) diethyl (2E)-4-(4-nitrophenyl)-4-oxo-2-butenylphosphonate Diethyl 3-(p-nitrobenzoyl)prop-2-en-1-phosphonate
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/h5-10H,3-4,11H2,1-2H3/b6-5+
InChIKey RLVBJJRWQSPREM-AATRIKPKSA-N
Molecular Weight 327.273 g/mol
SMILES c1(N(=O)=O)ccc(C(\C=C\CP(=O)(OCC)OCC)=O)cc1
SPLASH splash10-004i-0901000000-96ce790fdb8456a0978e
Source of Spectrum OP-31-218-6
Wiley ID 1577765