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/C13H15N3O2/c1-3-12(17)15-10-6-5-9-8-14-16(11(9)7-10)13(18)4-2/h5-8H,3-4H2,1-2H3,(H,15,17)
SMILES CCC(=O)Nc1ccc2c(c1)n(nc2)C(=O)CC
InChI Key XYXZVYXWLDBRLV-UHFFFAOYSA-N
Molecular Formula C13H15N3O2
Exact Mass 245.277 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/XYXZVYXWLDBRLV-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/XYXZVYXWLDBRLV-UHFFFAOYSA-N/CHMO0000595
Version
Author Niklas Krappel
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T01:17:04.499927
MetadataModified 2024-09-08T01:17:04.499933
MetadataPublished 2023-07-31
Field Value
Measurement Technique 13C nuclear magnetic resonance spectroscopy
Measurement Variables