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

*Links on SpectraBase are not permalinks.
trans, cis,cis-(10.4.4)Triannulene-16,18-dione
SpectraBase Compound ID Cq9vxu8qzGT
InChI InChI=1S/C21H32O2/c22-17-11-9-15-19-13-7-5-3-1-2-4-6-8-14-20(19)16-10-12-18(23)21(17,19)20/h1-16H2
InChIKey IENCBSAXFGHYFP-UHFFFAOYSA-N
Mol Weight 316.5 g/mol
Molecular Formula C21H32O2
Exact Mass 316.24023 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 g4UoVBtM8u
Name trans, cis,cis-(10.4.4)Triannulene-16,18-dione
CAS Registry Number 87336-99-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H32O2
InChI InChI=1S/C21H32O2/c22-17-11-9-15-19-13-7-5-3-1-2-4-6-8-14-20(19)16-10-12-18(23)21(17,19)20/h1-16H2
InChIKey IENCBSAXFGHYFP-UHFFFAOYSA-N
Literature Reference J.A. Marshall, J.C. Peterson, L. Lebioda, J. Am. Chem. Soc. 106, 6006 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3