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

*Links on SpectraBase are not permalinks.
anti-11,20-Dimethyl-2,13-dithia-(3)metacyclo(3)(1,3)-naphthalenophane
SpectraBase Compound ID GXkypz9EzZl
InChI InChI=1S/C22H22S2/c1-15-18-7-5-8-19(15)12-24-14-22-16(2)20(13-23-11-18)10-17-6-3-4-9-21(17)22/h3-10H,11-14H2,1-2H3
InChIKey YSSMYDVKYDLTEP-UHFFFAOYSA-N
Mol Weight 350.54 g/mol
Molecular Formula C22H22S2
Exact Mass 350.116293 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 5RgjDoiUDFw
Name syn-11,20-Dimethyl-2,13-dithia-(3)metacyclo(3)(1,3)-naphthalenophane
CAS Registry Number 80734-46-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H22S2
InChI InChI=1S/C22H22S2/c1-15-18-7-5-8-19(15)12-24-14-22-16(2)20(13-23-11-18)10-17-6-3-4-9-21(17)22/h3-10H,11-14H2,1-2H3
InChIKey YSSMYDVKYDLTEP-UHFFFAOYSA-N
Instrument Name Nicolet TT-14
Literature Reference R.H. Mitchell, R.J. Carruthers, L. Mazuch, J. Am. Chem. Soc. 104, 2544 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3