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1-[2-(Diphenylphosphino)phenyl]nonanone

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

1-[2-(Diphenylphosphino)phenyl]nonanone
SpectraBase Compound ID 7QMLpKSSPKa
InChI InChI=1S/C27H31OP/c1-2-3-4-5-6-13-21-26(28)25-20-14-15-22-27(25)29(23-16-9-7-10-17-23)24-18-11-8-12-19-24/h7-12,14-20,22H,2-6,13,21H2,1H3
InChIKey MFHGDNRXLYRHHK-UHFFFAOYSA-N
Mol Weight 402.52 g/mol
Molecular Formula C27H31OP
Exact Mass 402.211253 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 80CBfsob4s5
Name 1-[2-(Diphenylphosphino)phenyl]nonanone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 402.211252615 u
Formula C27H31OP
InChI InChI=1S/C27H31OP/c1-2-3-4-5-6-13-21-26(28)25-20-14-15-22-27(25)29(23-16-9-7-10-17-23)24-18-11-8-12-19-24/h7-12,14-20,22H,2-6,13,21H2,1H3
InChIKey MFHGDNRXLYRHHK-UHFFFAOYSA-N
Molecular Weight 402.518 g/mol
SMILES C=1(P(C=2C=CC=CC2)C=2C=CC=CC2)C(C(=O)CCCCCCCC)=CC=CC1