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/C29H30FN3/c1-28(2,3)22-13-7-19(8-14-22)25-31-26(20-9-15-23(16-10-20)29(4,5)6)33-27(32-25)21-11-17-24(30)18-12-21/h7-18H,1-6H3
SMILES Fc1ccc(cc1)c1nc(nc(n1)c1ccc(cc1)C(C)(C)C)c1ccc(cc1)C(C)(C)C
InChI Key HTKZMQNHDRKIHZ-UHFFFAOYSA-N
Molecular Formula C29H30FN3
Exact Mass 439.567 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/HTKZMQNHDRKIHZ-UHFFFAOYSA-N/CHMO0000597
License URL
Source https://www.chemotion-repository.net/inchikey/HTKZMQNHDRKIHZ-UHFFFAOYSA-N/CHMO0000597
Version
Author Zhen Zhang
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T03:52:29.247950
MetadataModified 2024-09-07T18:54:22.332503
MetadataPublished 2020-10-05
Field Value
Measurement Technique 19F nuclear magnetic resonance spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
154701152 PubChem
The data in this table is sourced from UniChem at EBI.