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Isopentyl-tris{( diphenylphosphanyl)methyl] methane

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

Isopentyl-tris{( diphenylphosphanyl)methyl] methane
SpectraBase Compound ID 7iwjEuj17XY
InChI InChI=1S/C45H47P3/c1-38(2)33-34-45(35-46(39-21-9-3-10-22-39)40-23-11-4-12-24-40,36-47(41-25-13-5-14-26-41)42-27-15-6-16-28-42)37-48(43-29-17-7-18-30-43)44-31-19-8-20-32-44/h3-32,38H,33-37H2,1-2H3
InChIKey XDCXGCBYOCVMMJ-UHFFFAOYSA-N
Mol Weight 680.8 g/mol
Molecular Formula C45H47P3
Exact Mass 680.289063 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4T4LiiVC03M
Name Isopentyl-tris{( diphenylphosphanyl)methyl] methane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 680.289062507 u
Formula C45H47P3
InChI InChI=1S/C45H47P3/c1-38(2)33-34-45(35-46(39-21-9-3-10-22-39)40-23-11-4-12-24-40,36-47(41-25-13-5-14-26-41)42-27-15-6-16-28-42)37-48(43-29-17-7-18-30-43)44-31-19-8-20-32-44/h3-32,38H,33-37H2,1-2H3
InChIKey XDCXGCBYOCVMMJ-UHFFFAOYSA-N
Molecular Weight 680.792 g/mol
SMILES C(CP(C1=CC=CC=C1)C1=CC=CC=C1)(CP(C1=CC=CC=C1)C1=CC=CC=C1)(CP(C1=CC=CC=C1)C1=CC=CC=C1)CCC(C)C