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(S)-1-{2-[(Diphenylphosphino)methyl]pyrrolidin-1-yl}-2,2,2-triphenylethanone

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(S)-1-{2-[(Diphenylphosphino)methyl]pyrrolidin-1-yl}-2,2,2-triphenylethanone
SpectraBase Compound ID 634qjBoWlA5
InChI InChI=1S/C37H34NOP/c39-36(37(30-17-6-1-7-18-30,31-19-8-2-9-20-31)32-21-10-3-11-22-32)38-28-16-23-33(38)29-40(34-24-12-4-13-25-34)35-26-14-5-15-27-35/h1-15,17-22,24-27,33H,16,23,28-29H2/t33-/m0/s1
InChIKey RWGGMUQPXDKCFW-XIFFEERXSA-N
Mol Weight 539.7 g/mol
Molecular Formula C37H34NOP
Exact Mass 539.237802 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2n4vHZZ9KGT
Name (S)-1-{2-[(Diphenylphosphino)methyl]pyrrolidin-1-yl}-2,2,2-triphenylethanone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 539.237801716 u
Formula C37H34NOP
InChI InChI=1S/C37H34NOP/c39-36(37(30-17-6-1-7-18-30,31-19-8-2-9-20-31)32-21-10-3-11-22-32)38-28-16-23-33(38)29-40(34-24-12-4-13-25-34)35-26-14-5-15-27-35/h1-15,17-22,24-27,33H,16,23,28-29H2/t33-/m0/s1
InChIKey RWGGMUQPXDKCFW-XIFFEERXSA-N
Molecular Weight 539.659 g/mol
SMILES C=1(C=CC=CC1)C(C(N1CCC[C@]1(CP(C1=CC=CC=C1)C1=CC=CC=C1)[H])=O)(C1=CC=CC=C1)C=1C=CC=CC1