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

*Links on SpectraBase are not permalinks.

Rubrene

View entire compound with spectra: 3 NMR, 3 FTIR, and 2 MS (GC)

Rubrene
SpectraBase Compound ID DM2z8FSFMd6
InChI InChI=1S/C42H28/c1-5-17-29(18-6-1)37-33-25-13-14-26-34(33)39(31-21-9-3-10-22-31)42-40(32-23-11-4-12-24-32)36-28-16-15-27-35(36)38(41(37)42)30-19-7-2-8-20-30/h1-28H
InChIKey YYMBJDOZVAITBP-UHFFFAOYSA-N
Mol Weight 532.7 g/mol
Molecular Formula C42H28
Exact Mass 532.219101 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 IQoYIscYnoe
Name Rubrene
CAS Registry Number 517-51-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C42H28
InChI InChI=1S/C42H28/c1-5-17-29(18-6-1)37-33-25-13-14-26-34(33)39(31-21-9-3-10-22-31)42-40(32-23-11-4-12-24-32)36-28-16-15-27-35(36)38(41(37)42)30-19-7-2-8-20-30/h1-28H
InChIKey YYMBJDOZVAITBP-UHFFFAOYSA-N
Instrument Name Jeol PFT-100
Literature Reference W. Storek, J. Sauer, R. Stoesser, Z. Naturforsch. 34A, 1334 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3