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3-Benzoyl-5-(1'-diphenylphosphinoylpropyl)-2-phenylisoxazolidine

View entire compound with spectra: 1 NMR, and 2 MS (GC)

3-Benzoyl-5-(1'-diphenylphosphinoylpropyl)-2-phenylisoxazolidine
SpectraBase Compound ID 5fVFm4wYSRp
InChI InChI=1S/C31H30NO3P/c1-2-30(36(34,26-19-11-5-12-20-26)27-21-13-6-14-22-27)29-23-28(31(33)24-15-7-3-8-16-24)32(35-29)25-17-9-4-10-18-25/h3-22,28-30H,2,23H2,1H3
InChIKey UTOWLARDJGCYEY-UHFFFAOYSA-N
Mol Weight 495.56 g/mol
Molecular Formula C31H30NO3P
Exact Mass 495.196331 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EQa9eTDiVnB
Name 3-Benzoyl-5-(1'-diphenylphosphinoylpropyl)-2-phenylisoxazolidine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 495.196330825 u
Formula C31H30NO3P
InChI InChI=1S/C31H30NO3P/c1-2-30(36(34,26-19-11-5-12-20-26)27-21-13-6-14-22-27)29-23-28(31(33)24-15-7-3-8-16-24)32(35-29)25-17-9-4-10-18-25/h3-22,28-30H,2,23H2,1H3
InChIKey UTOWLARDJGCYEY-UHFFFAOYSA-N
Molecular Weight 495.559 g/mol
SMILES C1(N(OC(C1)C(P(=O)(C1=CC=CC=C1)C1=CC=CC=C1)CC)C1=CC=CC=C1)C(=O)C1=CC=CC=C1