Dataset

19F nuclear magnetic resonance spectroscopy (19F NMR)

dataset for 19F nuclear magnetic resonance spectroscopy (19F NMR)

Chemical Information

molecular Image
InChI InChI=1S/C25H11F15N2O3/c26-19(27,20(28,29)21(30,31)22(32,33)23(34,35)24(36,37)25(38,39)40)18(45)41-15-10-4-1-6-12(15)7-5-11-42-16(43)13-8-2-3-9-14(13)17(42)44/h1-4,6,8-10H,11H2,(H,41,45)
SMILES O=C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Nc1ccccc1C#CCN1C(=O)c2c(C1=O)cccc2
InChI Key SGHSOLFNZSDAHV-UHFFFAOYSA-N
Molecular Formula C25H11F15N2O3
Exact Mass 672.342 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/SGHSOLFNZSDAHV-UHFFFAOYSA-N/CHMO0000597
License URL
Source https://www.chemotion-repository.net/inchikey/SGHSOLFNZSDAHV-UHFFFAOYSA-N/CHMO0000597
Version
Author Helena Šimek
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-09-15
Related Molecule
  • N-[2-[3-(1,3-dioxoisoindol-2-yl)prop-1-ynyl]phenyl]-2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctanamide
    • Field Value
    Measurement Technique 19F nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    164889731 pubchem
    The data in this table is sourced from UniChem at EBI.