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6-(2-DIETHOXYPHOSPHORYL-2-PENTYLAMINO)-4,4-BIS(TRIFLUOROMETHYL)-3,4-DIHYDRO-1,3,5-TRIAZIN-2(1H)-ONE
SpectraBase Compound ID BebZC1304Q5
InChI InChI=1S/C14H23F6N4O4P/c1-5-8-11(4,29(26,27-6-2)28-7-3)22-9-21-10(25)24-12(23-9,13(15,16)17)14(18,19)20/h5-8H2,1-4H3,(H3,21,22,23,24,25)
InChIKey PKQWFWVFLLNZSW-UHFFFAOYSA-N
Mol Weight 456.33 g/mol
Molecular Formula C14H23F6N4O4P
Exact Mass 456.136111 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Amjd9P8iluC
Name 6-(2-DIETHOXYPHOSPHORYL-2-PENTYLAMINO)-4,4-BIS(TRIFLUOROMETHYL)-3,4-DIHYDRO-1,3,5-TRIAZIN-2(1H)-ONE
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Formula C14H23F6N4O4P
InChI InChI=1S/C14H23F6N4O4P/c1-5-8-11(4,29(26,27-6-2)28-7-3)22-9-21-10(25)24-12(23-9,13(15,16)17)14(18,19)20/h5-8H2,1-4H3,(H3,21,22,23,24,25)
InChIKey PKQWFWVFLLNZSW-UHFFFAOYSA-N
Instrument Name Bruker CXP-200
Literature Reference I.V.MARTYNOV, A.YU.AKSINENKO, A.N.CHEKHLOV, O.V.KORENCHENKO, I.N.TORGUN,V.B.SOKOLOV (1989) Zhurn.Obsch.Khim.(Russ. Lang.): v.59, N6, 1397-1400.
NMR Standard CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2D6SO dimethylsulfo