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/C23H18F3N3O3/c24-23(25,26)15-8-9-16-17(11-15)20-19(32-22(16)30)7-4-10-31-13-18-21(20)27-28-29(18)12-14-5-2-1-3-6-14/h1-3,5-6,8-9,11H,4,7,10,12-13H2
SMILES O=c1oc2CCCOCc3c(-c2c2c1ccc(c2)C(F)(F)F)nnn3Cc1ccccc1
InChI Key NNYNOTOJFURLPF-UHFFFAOYSA-N
Molecular Formula C23H18F3N3O3
Exact Mass 441.403 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/NNYNOTOJFURLPF-UHFFFAOYSA-N/CHMO0000597
License URL
Source https://www.chemotion-repository.net/inchikey/NNYNOTOJFURLPF-UHFFFAOYSA-N/CHMO0000597
Version
Author Irina Balova
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T01:02:57.098926
MetadataModified 2024-09-08T01:02:57.098931
MetadataPublished 2023-06-02
Field Value
Measurement Technique 19F nuclear magnetic resonance spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
168301080 PubChem
The data in this table is sourced from UniChem at EBI.