Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR) ()

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Info

molecular Image
InChI InChI=1S/C9H8N6O2/c1-6(16)17-5-8-4-15(14-12-8)9-7(2-10)3-11-13-9/h3-4H,5H2,1H3,(H,11,13)
SMILES CC(=O)OCc1cn(-c2n[nH]cc2C#N)nn1
InChI Key QROBBVJEUOFHFJ-UHFFFAOYSA-N
Molecular Formula C9H8N6O2

Data and Resources

Related Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source
Version
Author Gräßle, Simone, Wippert, Nicolai
Maintainer chemotion-repository
Language en
MetadataCreated 2024-02-18T03:18:19.933727
MetadataModified 2024-02-18T03:18:19.933732
MetadataPublished
Field Value
Measurement Technique
Measurement Variables