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2-[(Diphenylphosphoryl)-methyl]-6-(formamidomethyl)-pyridine-1-oxide
SpectraBase Compound ID 63U475BtLZI
InChI InChI=1S/C20H19N2O3P/c23-16-21-14-17-8-7-9-18(22(17)24)15-26(25,19-10-3-1-4-11-19)20-12-5-2-6-13-20/h1-13,16H,14-15H2,(H,21,23)
InChIKey QJTGWMHZRAGODE-UHFFFAOYSA-N
Mol Weight 366.36 g/mol
Molecular Formula C20H19N2O3P
Exact Mass 366.113329 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 84At6ffNbeA
Name 2-[(Diphenylphosphoryl)-methyl]-6-(formamidomethyl)-pyridine-1-oxide
Comments Computed using HOSE algorithm
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Exact Mass 366.113329475 u
Formula C20H19N2O3P
InChI InChI=1S/C20H19N2O3P/c23-16-21-14-17-8-7-9-18(22(17)24)15-26(25,19-10-3-1-4-11-19)20-12-5-2-6-13-20/h1-13,16H,14-15H2,(H,21,23)
InChIKey QJTGWMHZRAGODE-UHFFFAOYSA-N
Molecular Weight 366.357 g/mol
SMILES C1(=N(C(=CC=C1)CP(=O)(C1=CC=CC=C1)C1=CC=CC=C1)=O)CNC=O