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8-Butoxy-4,5-diphenyl-2-para-tolyl-1-phosphabicyclo-[2.2.2]-octa-2,5-diene-1-sulfide
SpectraBase Compound ID IjI1nMU509z
InChI InChI=1S/C30H31OPS/c1-3-4-19-31-29-22-32(33)21-27(24-11-7-5-8-12-24)30(29,26-13-9-6-10-14-26)20-28(32)25-17-15-23(2)16-18-25/h5-18,20-21,29H,3-4,19,22H2,1-2H3/t29?,30-,32+/m1/s1
InChIKey OJMOAOFFBRRZFH-MFDMQZOCSA-N
Mol Weight 470.61 g/mol
Molecular Formula C30H31OPS
Exact Mass 470.183324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1yCM1X7QEQR
Name 8-Butoxy-4,5-diphenyl-2-para-tolyl-1-phosphabicyclo-[2.2.2]-octa-2,5-diene-1-sulfide
CAS Registry Number 113613-18-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C30H31OPS
InChI InChI=1S/C30H31OPS/c1-3-4-19-31-29-22-32(33)21-27(24-11-7-5-8-12-24)30(29,26-13-9-6-10-14-26)20-28(32)25-17-15-23(2)16-18-25/h5-18,20-21,29H,3-4,19,22H2,1-2H3/t29?,30-,32+/m1/s1
InChIKey OJMOAOFFBRRZFH-MFDMQZOCSA-N
Instrument Name SF = 100 MHz
Literature Reference Bull. Chem. Soc. Jap. 1558 (1987).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3