Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C9H6F3NO2/c10-9(11,12)5-4-7-2-1-3-8(6-7)13(14)15/h1-6H/b5-4-
SMILES [O-][N+](=O)c1cccc(c1)/C=C\C(F)(F)F
InChI Key ZWZFNZQPQSEOFG-PLNGDYQASA-N
Molecular Formula C9H6F3NO2
Exact Mass 217.145 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/ZWZFNZQPQSEOFG-PLNGDYQASA-N/NMR/1H/CDCl3/400
License URL
Source https://www.chemotion-repository.net/inchikey/ZWZFNZQPQSEOFG-PLNGDYQASA-N/NMR/1H/CDCl3/400
Version
Author Andreas Hafner
Maintainer Chemotion Repository
Language english
MetadataPublished 2014-05-27
Related Molecule
  • 1-nitro-3-[(Z)-3,3,3-trifluoroprop-1-enyl]benzene
    • Field Value
    Measurement Technique 1H nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    72793504 PubChem
    The data in this table is sourced from UniChem at EBI.