For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1,6-Bis(4-tolylsulfinyl)-hexa-2,4-diyne
SpectraBase Compound ID LbomPy0v7hZ
InChI InChI=1S/C20H18O2S2/c1-17-7-11-19(12-8-17)23(21)15-5-3-4-6-16-24(22)20-13-9-18(2)10-14-20/h7-14H,15-16H2,1-2H3
InChIKey IQHJPRJGRNRQOJ-UHFFFAOYSA-N
Mol Weight 354.48 g/mol
Molecular Formula C20H18O2S2
Exact Mass 354.074822 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID ChJo3pNkn84
Name 1,6-Bis(4-tolylsulfinyl)-hexa-2,4-diyne
CAS Registry Number 88018-60-4
Comments C9,C11,C15 AND C17 ARE CHANGED FROM 124.80 PPM TO 129.80 PPM (PRINTING ERROR !)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H18O2S2
InChI InChI=1S/C20H18O2S2/c1-17-7-11-19(12-8-17)23(21)15-5-3-4-6-16-24(22)20-13-9-18(2)10-14-20/h7-14H,15-16H2,1-2H3
InChIKey IQHJPRJGRNRQOJ-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference K.C. Majumdar, R.N. De, B.K.Sen, Magn. Res. Chem. 26, 626 (1988).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3