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/C20H14BrN3/c21-15-11-17-18(12-16(15)22)24-20(14-9-5-2-6-10-14)19(23-17)13-7-3-1-4-8-13/h1-12H,22H2
SMILES Nc1cc2nc(c3ccccc3)c(nc2cc1Br)c1ccccc1
InChI Key FXKWIKWIQNADDJ-UHFFFAOYSA-N
Molecular Formula C20H14BrN3
Exact Mass 376.249 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/FXKWIKWIQNADDJ-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/FXKWIKWIQNADDJ-UHFFFAOYSA-N/CHMO0000595
Version
Author Laura Holzhauer
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T04:01:25.185672
MetadataModified 2024-09-08T04:01:25.185678
MetadataPublished 2024-07-05
Field Value
Measurement Technique 13C nuclear magnetic resonance spectroscopy
Measurement Variables