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di-N-Butyl-1-[N-(phenyl)-amino]-3-phenyl-2-propenyl-phosphonate
SpectraBase Compound ID Cco7z6P05V0
InChI InChI=1S/C23H32NO3P/c1-3-5-19-26-28(25,27-20-6-4-2)23(24-22-15-11-8-12-16-22)18-17-21-13-9-7-10-14-21/h7-18,23-24H,3-6,19-20H2,1-2H3/b18-17+
InChIKey VLGSHKMWLSUNHJ-ISLYRVAYSA-N
Mol Weight 401.5 g/mol
Molecular Formula C23H32NO3P
Exact Mass 401.211981 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cx3TsZ9UiBD
Name di-N-Butyl-1-[N-(phenyl)-amino]-3-phenyl-2-propenyl-phosphonate
Comments Computed using HOSE algorithm
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Exact Mass 401.211980889 u
Formula C23H32NO3P
InChI InChI=1S/C23H32NO3P/c1-3-5-19-26-28(25,27-20-6-4-2)23(24-22-15-11-8-12-16-22)18-17-21-13-9-7-10-14-21/h7-18,23-24H,3-6,19-20H2,1-2H3/b18-17+
InChIKey VLGSHKMWLSUNHJ-ISLYRVAYSA-N
Molecular Weight 401.487 g/mol
SMILES C(P(=O)(OCCCC)OCCCC)(\C=C\C1=CC=CC=C1)NC1=CC=CC=C1