Dataset

heteronuclear multiple bond coherence (HMBC)

dataset for heteronuclear multiple bond coherence (HMBC)

Chemical Information

molecular Image
InChI InChI=1S/C18H20N6/c1-3-4-5-17-13-24(22-20-17)18-16(10-19)12-23(21-18)11-15-8-6-14(2)7-9-15/h6-9,12-13H,3-5,11H2,1-2H3
SMILES CCCCc1nnn(c1)c1nn(cc1C#N)Cc1ccc(cc1)C
InChI Key FGLOKNGZLSDWMZ-UHFFFAOYSA-N
Molecular Formula C18H20N6
Exact Mass 320.392 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/FGLOKNGZLSDWMZ-UHFFFAOYSA-N/CHMO0000601
License URL
Source https://www.chemotion-repository.net/inchikey/FGLOKNGZLSDWMZ-UHFFFAOYSA-N/CHMO0000601
Version
Author Nicolai Wippert
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-02-14
Related Molecule
  • 3-(4-butyltriazol-1-yl)-1-[(4-methylphenyl)methyl]pyrazole-4-carbonitrile
    • Field Value
    Measurement Technique heteronuclear multiple bond coherence
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.