Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C9H9N2O2.BF4/c1-2-13-9(12)7-3-5-8(11-10)6-4-7;2-1(3,4)5/h3-6H,2H2,1H3;/q+1;-1
SMILES F[B-](F)(F)F.CCOC(=O)c1ccc(cc1)[N+]#N
InChI Key IRICWKXXVNWCQU-UHFFFAOYSA-N
Molecular Formula C9H9BF4N2O2
Exact Mass 263.985 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/IRICWKXXVNWCQU-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/IRICWKXXVNWCQU-UHFFFAOYSA-N/CHMO0000595
Version
Author Christoph Zippel
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-01-02
Related Molecule
  • 4-ethoxycarbonylbenzenediazonium;tetrafluoroborate
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.