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1,4-BIS(TRIPHENYLPHOSPHONIO)-2-PHENYLTHIOBUT-2-ENE DIIODIDE
SpectraBase Compound ID 8EQLTRg42xj
InChI InChI=1S/C46H40P2S.2HI/c1-8-22-39(23-9-1)47(40-24-10-2-11-25-40,41-26-12-3-13-27-41)37-36-46(49-45-34-20-7-21-35-45)38-48(42-28-14-4-15-29-42,43-30-16-5-17-31-43)44-32-18-6-19-33-44;;/h1-36H,37-38H2;2*1H/q+2;;/p-2/b46-36-;;
InChIKey YKNRAHWEGQCEDQ-IQDUMGHMSA-L
Mol Weight 940.64247 g/mol
Molecular Formula C46H40I2P2S
Exact Mass 940.041536 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 91ap5bPrCf5
Name 1,4-BIS(TRIPHENYLPHOSPHONIO)-2-PHENYLTHIOBUT-2-ENE DIIODIDE
Comments , J(C-P) FOR AMBIGIOUSLY ASSIGNED PEAKS IN 13C SPECTRA: 31.5(J=47.3);
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C46H40I2P2S
InChI InChI=1S/C46H40P2S.2HI/c1-8-22-39(23-9-1)47(40-24-10-2-11-25-40,41-26-12-3-13-27-41)37-36-46(49-45-34-20-7-21-35-45)38-48(42-28-14-4-15-29-42,43-30-16-5-17-31-43)44-32-18-6-19-33-44;;/h1-36H,37-38H2;2*1H/q+2;;/p-2/b46-36-;;
InChIKey YKNRAHWEGQCEDQ-IQDUMGHMSA-L
Instrument Name Bruker WP-80
Literature Reference FRANCOISE PLENAT, AHMED BENNAMARA, LAURENT CHICHE, HENRI CHRISTOL (1986)Phosphorus and Sulfur: v.26, N1, 39-51.
NMR Standard H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported