Dataset

1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)

dataset for 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)

Chemical Information

molecular Image
InChI InChI=1S/C17H21N5/c1-4-5-8-13-11-22(21-20-13)17-16(12(2)3)18-14-9-6-7-10-15(14)19-17/h6-7,9-12H,4-5,8H2,1-3H3
SMILES CCCCc1nnn(c1)c1nc2ccccc2nc1C(C)C
InChI Key YKTZEDKRYOIMNU-UHFFFAOYSA-N
Molecular Formula C17H21N5
Exact Mass 295.382 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/YKTZEDKRYOIMNU-UHFFFAOYSA-N/CHMO0001148
License URL
Source https://www.chemotion-repository.net/inchikey/YKTZEDKRYOIMNU-UHFFFAOYSA-N/CHMO0001148
Version
Author Laura Holzhauer
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-02-11
Related Molecule
  • 2-(4-butyltriazol-1-yl)-3-propan-2-ylquinoxaline
    • Field Value
    Measurement Technique 1H–13C heteronuclear multiple bond coherence
    Measurement Variables
    Data-Source Molecule ID Data-Source
    162623392 PubChem
    The data in this table is sourced from UniChem at EBI.