SpectraBase Spectrum ID |
JXzamgdvcMj |
Name |
8-Aza-theophylline |
Comments |
PREDOMINANT TAUTOMER |
Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula |
C6H7N5O2 |
InChI |
InChI=1S/C6H7N5O2/c1-10-4-3(7-9-8-4)5(12)11(2)6(10)13/h1-2H3,(H,7,8,9) |
InChIKey |
YSKBPNLSRKSFFI-UHFFFAOYSA-N |
Instrument Name |
Bruker WM-250 |
Literature Reference |
G. L'Abbe, M.A. Persoons, S. Toppet, Magn. Res. Chem. 25, 362 (1987). |
NMR Standard |
TMS |
Origin |
Chemical Concepts. A Wiley Division. Weinheim, Germany |
Solvent |
DMSO-D6 |