Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

molecular Image
InChI InChI=1S/C6H9N/c7-5-6-3-1-2-4-6/h6H,1-4H2
SMILES N#CC1CCCC1
InChI Key SVPZJHKVRMRREG-UHFFFAOYSA-N
Exact Mass 95.142 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/SVPZJHKVRMRREG-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/SVPZJHKVRMRREG-UHFFFAOYSA-N/CHMO0000595
Version
Author Jana Barylko
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-05-12
Related Molecule
  • cyclopentanecarbonitrile
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    56954 surechembl
    77935 pubchem
    K6Y8BG5QK2 fdasrs
    123711 brenda
    96309 brenda
    Molport-003-929-486 molport
    The data in this table is sourced from UniChem at EBI.