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/C29H20F3NO/c30-29(31,32)26-17-9-8-16-25(26)28(34)33(21-23-13-5-2-6-14-23)27-18-10-7-15-24(27)20-19-22-11-3-1-4-12-22/h1-18H,21H2
SMILES O=C(c1ccccc1C(F)(F)F)N(c1ccccc1C#Cc1ccccc1)Cc1ccccc1
InChI Key LQJAQJSXWKWJFU-UHFFFAOYSA-N
Molecular Formula C29H20F3NO
Exact Mass 455.470 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/LQJAQJSXWKWJFU-UHFFFAOYSA-N/CHMO0000597
License URL
Source https://www.chemotion-repository.net/inchikey/LQJAQJSXWKWJFU-UHFFFAOYSA-N/CHMO0000597
Version
Author Helena Šimek
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T08:04:42.282534
MetadataModified 2024-09-07T23:58:26.227652
MetadataPublished 2022-12-19
Field Value
Measurement Technique 19F nuclear magnetic resonance spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
166175708 PubChem
The data in this table is sourced from UniChem at EBI.