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

*Links on SpectraBase are not permalinks.
anti-9,21-Dimethyl-benzo(10,11-A)-2-thia(2.3)metacyclophane
SpectraBase Compound ID Ia23hobRMPN
InChI InChI=1S/C22H20S/c1-15-17-7-5-11-19(15)21-9-3-4-10-22(21)20-12-6-8-18(16(20)2)14-23-13-17/h3-12H,13-14H2,1-2H3
InChIKey QXEVDSNDWVKFMB-UHFFFAOYSA-N
Mol Weight 316.46 g/mol
Molecular Formula C22H20S
Exact Mass 316.128572 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 BT5kfs1h2r2
Name anti-9,21-Dimethyl-benzo(10,11-A)-2-thia(2.3)metacyclophane
CAS Registry Number 65649-30-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H20S
InChI InChI=1S/C22H20S/c1-15-17-7-5-11-19(15)21-9-3-4-10-22(21)20-12-6-8-18(16(20)2)14-23-13-17/h3-12H,13-14H2,1-2H3
InChIKey QXEVDSNDWVKFMB-UHFFFAOYSA-N
Instrument Name Nicolet TT-14
Literature Reference R.H. Mitchell, J.S. Yan, T.W.Dingle, J. Am. Chem. Soc. 104, 2551 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3