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/C8H11N5/c9-12-10-8-5-6-13(11-8)7-3-1-2-4-7/h5-7H,1-4H2
SMILES [N-]=[N+]=Nc1ccn(n1)C1CCCC1
InChI Key CEJMUQXTWWQJBT-UHFFFAOYSA-N
Molecular Formula C8H11N5
Exact Mass 177.206 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/CEJMUQXTWWQJBT-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/CEJMUQXTWWQJBT-UHFFFAOYSA-N/CHMO0000595
Version
Author Nicolai Wippert
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T02:53:48.665255
MetadataModified 2024-09-08T02:53:48.665261
MetadataPublished 2024-02-14
Field Value
Measurement Technique 13C nuclear magnetic resonance spectroscopy
Measurement Variables