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/C21H19N5O3/c1-3-29-21(27)18-13-25(16-9-11-17(28-2)12-10-16)23-20(18)26-14-19(22-24-26)15-7-5-4-6-8-15/h4-14H,3H2,1-2H3
SMILES CCOC(=O)c1cn(nc1n1nnc(c1)c1ccccc1)c1ccc(cc1)OC
InChI Key UEMJXDBBUGZBJY-UHFFFAOYSA-N
Molecular Formula C21H19N5O3
Exact Mass 389.407 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/UEMJXDBBUGZBJY-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/UEMJXDBBUGZBJY-UHFFFAOYSA-N/CHMO0000595
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T03:24:58.722036
MetadataModified 2024-09-08T03:24:58.722042
MetadataPublished 2024-05-07
Field Value
Measurement Technique 13C nuclear magnetic resonance spectroscopy
Measurement Variables