Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Information

molecular Image
InChI InChI=1S/C23H17N7O2/c1-15-6-8-16(9-7-15)11-28-12-17(10-24)21(26-28)30-14-18(25-27-30)13-29-22(31)19-4-2-3-5-20(19)23(29)32/h2-9,12,14H,11,13H2,1H3
SMILES N#Cc1cn(nc1n1nnc(c1)CN1C(=O)c2c(C1=O)cccc2)Cc1ccc(cc1)C
InChI Key FODYZQGXSSTMHJ-UHFFFAOYSA-N
Molecular Formula C23H17N7O2
Exact Mass 423.427 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/FODYZQGXSSTMHJ-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/FODYZQGXSSTMHJ-UHFFFAOYSA-N/CHMO0000593
Version
Author Nicolai Wippert
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-02-14
Related Molecule
  • 3-[4-[(1,3-dioxoisoindol-2-yl)methyl]triazol-1-yl]-1-[(4-methylphenyl)methyl]pyrazole-4-carbonitrile
    • Field Value
    Measurement Technique 1H nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.