Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C17H17FN2S2/c18-14-7-9-15(10-8-14)19-20-16(13-5-2-1-3-6-13)17-21-11-4-12-22-17/h1-3,5-10,17,19H,4,11-12H2/b20-16+
SMILES Fc1ccc(cc1)N/N=C(\c1ccccc1)/C1SCCCS1
InChI Key QDPNXEBIDUXHCH-CAPFRKAQSA-N
Molecular Formula C17H17FN2S2
Exact Mass 332.459 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/QDPNXEBIDUXHCH-CAPFRKAQSA-N/NMR/1H/CDCl3/300
License URL
Source https://www.chemotion-repository.net/inchikey/QDPNXEBIDUXHCH-CAPFRKAQSA-N/NMR/1H/CDCl3/300
Version
Author Bettina Stanek
Maintainer Chemotion Repository
Language english
MetadataPublished 2014-05-27
Related Molecule
  • N-[(E)-[1,3-dithian-2-yl(phenyl)methylidene]amino]-4-fluoroaniline
    • Field Value
    Measurement Technique 1H nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    73427409 PubChem
    The data in this table is sourced from UniChem at EBI.