Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Info

molecular Image
InChI InChI=1S/C11H6F2N6/c12-9-1-7(2-10(13)3-9)5-19-6-8(4-14)11(17-19)16-18-15/h1-3,6H,5H2
SMILES [N-]=[N+]=Nc1nn(cc1C#N)Cc1cc(F)cc(c1)F
InChI Key WBMURKUEYYRUPK-UHFFFAOYSA-N
Molecular Formula C11H6F2N6
Exact Mass 260.202 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/WBMURKUEYYRUPK-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/WBMURKUEYYRUPK-UHFFFAOYSA-N/CHMO0000595
Version
Author Nicolai Wippert
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T02:50:43.536245
MetadataModified 2024-09-08T02:50:43.536251
MetadataPublished 2024-02-14
Field Value
Measurement Technique 13C nuclear magnetic resonance spectroscopy
Measurement Variables