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5-Methyl-2-(triphenylphosphoranylideneamino)-benzaldehyde-ethylene-acetal

View entire compound with spectra: 2 NMR

5-Methyl-2-(triphenylphosphoranylideneamino)-benzaldehyde-ethylene-acetal
SpectraBase Compound ID HPJMIEriNvn
InChI InChI=1S/C28H26NO2P/c1-22-17-18-27(26(21-22)28-30-19-20-31-28)29-32(23-11-5-2-6-12-23,24-13-7-3-8-14-24)25-15-9-4-10-16-25/h2-18,21,28H,19-20H2,1H3
InChIKey VQCGKPSEBYRQBH-UHFFFAOYSA-N
Mol Weight 439.49 g/mol
Molecular Formula C28H26NO2P
Exact Mass 439.170116 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C7gJT68KBXp
Name 5-Methyl-2-(triphenylphosphoranylideneamino)-benzaldehyde-ethylene-acetal
Comments Computed using HOSE algorithm
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Exact Mass 439.170116077 u
Formula C28H26NO2P
InChI InChI=1S/C28H26NO2P/c1-22-17-18-27(26(21-22)28-30-19-20-31-28)29-32(23-11-5-2-6-12-23,24-13-7-3-8-14-24)25-15-9-4-10-16-25/h2-18,21,28H,19-20H2,1H3
InChIKey VQCGKPSEBYRQBH-UHFFFAOYSA-N
Molecular Weight 439.495 g/mol
SMILES C1(N=P(C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)=C(C2OCCO2)C=C(C=C1)C