Dataset

19F nuclear magnetic resonance spectroscopy (19F NMR)

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

Chemical Info

molecular Image
InChI InChI=1S/C18H12F3N3O/c1-25-12-6-4-5-11(9-12)15-10-22-17-16(18(19,20)21)23-13-7-2-3-8-14(13)24(15)17/h2-10H,1H3
SMILES COc1cccc(c1)c1cnc2n1c1ccccc1nc2C(F)(F)F
InChI Key RGFFLDSTQTWVHZ-UHFFFAOYSA-N
Molecular Formula C18H12F3N3O
Exact Mass 343.303 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/RGFFLDSTQTWVHZ-UHFFFAOYSA-N/CHMO0000597
License URL
Source https://www.chemotion-repository.net/inchikey/RGFFLDSTQTWVHZ-UHFFFAOYSA-N/CHMO0000597
Version
Author Laura Holzhauer
Maintainer Chemotion Repository
Language english
MetadataCreated 2025-03-15T03:12:26.479282
MetadataModified 2025-03-16T03:11:31.143772
MetadataPublished 2025-03-14
Related Molecule