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Diphenyl 1-N-carbobenzyloxyphenylalanylamino-2-phenylethylphosphonate

View entire compound with spectra: 1 NMR

Diphenyl 1-N-carbobenzyloxyphenylalanylamino-2-phenylethylphosphonate
SpectraBase Compound ID AXXMa9TCbRk
InChI InChI=1S/C37H35N2O6P/c40-36(34(26-29-16-6-1-7-17-29)38-37(41)43-28-31-20-10-3-11-21-31)39-35(27-30-18-8-2-9-19-30)46(42,44-32-22-12-4-13-23-32)45-33-24-14-5-15-25-33/h1-25,34-35H,26-28H2,(H,38,41)(H,39,40)
InChIKey ISLUYOHZRVFCAS-UHFFFAOYSA-N
Mol Weight 634.7 g/mol
Molecular Formula C37H35N2O6P
Exact Mass 634.223274 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3icqRze1Qm3
Name Diphenyl 1-N-carbobenzyloxyphenylalanylamino-2-phenylethylphosphonate
Comments Computed using HOSE algorithm
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Exact Mass 634.223273847 u
Formula C37H35N2O6P
InChI InChI=1S/C37H35N2O6P/c40-36(34(26-29-16-6-1-7-17-29)38-37(41)43-28-31-20-10-3-11-21-31)39-35(27-30-18-8-2-9-19-30)46(42,44-32-22-12-4-13-23-32)45-33-24-14-5-15-25-33/h1-25,34-35H,26-28H2,(H,38,41)(H,39,40)
InChIKey ISLUYOHZRVFCAS-UHFFFAOYSA-N
Molecular Weight 634.669 g/mol
SMILES C1=C(C=CC=C1)CC(NC(OCC1=CC=CC=C1)=O)C(NC(CC1=CC=CC=C1)P(OC1=CC=CC=C1)(=O)OC1=CC=CC=C1)=O