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N~1~,N~8~-bis{2-[2-(diphenylphosphoryl)phenoxy]ethyl}-1,8-naphthalenediamine

View entire compound with spectra: 2 NMR

N~1~,N~8~-bis{2-[2-(diphenylphosphoryl)phenoxy]ethyl}-1,8-naphthalenediamine
SpectraBase Compound ID 5R8bnxtPLJv
InChI InChI=1S/C50H44N2O4P2/c53-57(40-21-5-1-6-22-40,41-23-7-2-8-24-41)48-33-15-13-31-46(48)55-37-35-51-44-29-17-19-39-20-18-30-45(50(39)44)52-36-38-56-47-32-14-16-34-49(47)58(54,42-25-9-3-10-26-42)43-27-11-4-12-28-43/h1-34,51-52H,35-38H2
InChIKey PDWRHCZEAWHZED-UHFFFAOYSA-N
Mol Weight 798.9 g/mol
Molecular Formula C50H44N2O4P2
Exact Mass 798.277632 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2dDwfpzKKXU
Name N~1~,N~8~-bis{2-[2-(Diphenylphosphoryl)phenoxy]ethyl}-1,8-naphthalenediamine
Comments Computed using HOSE algorithm
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Exact Mass 798.277631897 u
Formula C50H44N2O4P2
InChI InChI=1S/C50H44N2O4P2/c53-57(40-21-5-1-6-22-40,41-23-7-2-8-24-41)48-33-15-13-31-46(48)55-37-35-51-44-29-17-19-39-20-18-30-45(50(39)44)52-36-38-56-47-32-14-16-34-49(47)58(54,42-25-9-3-10-26-42)43-27-11-4-12-28-43/h1-34,51-52H,35-38H2
InChIKey PDWRHCZEAWHZED-UHFFFAOYSA-N
Molecular Weight 798.860 g/mol
SMILES N(C1=C2C(=CC=CC2=CC=C1)NCCOC1=C(P(=O)(C2=CC=CC=C2)C=2C=CC=CC2)C=CC=C1)CCOC1=C(P(=O)(C2=CC=CC=C2)C2=CC=CC=C2)C=CC=C1