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(1S,2S)-2-(Dibenzylamino)-1-[2-(diphenylphosphinyl)-phenyl]-porpan-1-ol

View entire compound with spectra: 2 NMR

(1S,2S)-2-(Dibenzylamino)-1-[2-(diphenylphosphinyl)-phenyl]-porpan-1-ol
SpectraBase Compound ID 3BqwabFF2v
InChI InChI=1S/C35H34NO2P/c1-28(36(26-29-16-6-2-7-17-29)27-30-18-8-3-9-19-30)35(37)33-24-14-15-25-34(33)39(38,31-20-10-4-11-21-31)32-22-12-5-13-23-32/h2-25,28,35,37H,26-27H2,1H3/t28-,35+/m0/s1
InChIKey DMXZAYQMGHVNPS-JADSYQMUSA-N
Mol Weight 531.6 g/mol
Molecular Formula C35H34NO2P
Exact Mass 531.232716 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9hEoiuxWix
Name (1S,2S)-2-(Dibenzylamino)-1-[2-(diphenylphosphinyl)-phenyl]-porpan-1-ol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 531.232716335 u
Formula C35H34NO2P
InChI InChI=1S/C35H34NO2P/c1-28(36(26-29-16-6-2-7-17-29)27-30-18-8-3-9-19-30)35(37)33-24-14-15-25-34(33)39(38,31-20-10-4-11-21-31)32-22-12-5-13-23-32/h2-25,28,35,37H,26-27H2,1H3/t28-,35+/m0/s1
InChIKey DMXZAYQMGHVNPS-JADSYQMUSA-N
Molecular Weight 531.636 g/mol
SMILES C1(P(=O)(C2=CC=CC=C2)C2=C(C=CC=C2)[C@](O)([C@](C)(N(CC2=CC=CC=C2)CC2=CC=CC=C2)[H])[H])=CC=CC=C1