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(S)-1-(2-[(Benzyloxy)-methyl]-pyrrolidin-1-yl)-3-(diphenylphosphino)-propan-1-one

View entire compound with spectra: 3 NMR

(S)-1-(2-[(Benzyloxy)-methyl]-pyrrolidin-1-yl)-3-(diphenylphosphino)-propan-1-one
SpectraBase Compound ID Gki9pF0llNJ
InChI InChI=1S/C27H30NO2P/c29-27(28-19-10-13-24(28)22-30-21-23-11-4-1-5-12-23)18-20-31(25-14-6-2-7-15-25)26-16-8-3-9-17-26/h1-9,11-12,14-17,24H,10,13,18-22H2/t24-/m0/s1
InChIKey YLGSXMHQDGFQLJ-DEOSSOPVSA-N
Mol Weight 431.52 g/mol
Molecular Formula C27H30NO2P
Exact Mass 431.201416 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2rZ0aUDsSXO
Name (S)-1-(2-[(Benzyloxy)-methyl]-pyrrolidin-1-yl)-3-(diphenylphosphino)-propan-1-one
Comments Computed using HOSE algorithm
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Exact Mass 431.201416206 u
Formula C27H30NO2P
InChI InChI=1S/C27H30NO2P/c29-27(28-19-10-13-24(28)22-30-21-23-11-4-1-5-12-23)18-20-31(25-14-6-2-7-15-25)26-16-8-3-9-17-26/h1-9,11-12,14-17,24H,10,13,18-22H2/t24-/m0/s1
InChIKey YLGSXMHQDGFQLJ-DEOSSOPVSA-N
Molecular Weight 431.516 g/mol
SMILES C(OCC=1C=CC=CC1)[C@@]1(CCCN1C(=O)CCP(C1=CC=CC=C1)C1=CC=CC=C1)[H]