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/C17H12F2NP/c18-13-4-8-15(9-5-13)21(17-3-1-2-12-20-17)16-10-6-14(19)7-11-16/h1-12H
SMILES Fc1ccc(cc1)P(c1ccccn1)c1ccc(cc1)F
InChI Key MFVBUTOBVQRHOJ-UHFFFAOYSA-N
Molecular Formula C17H12F2NP
Exact Mass 299.254 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/MFVBUTOBVQRHOJ-UHFFFAOYSA-N/CHMO0000597
License URL
Source https://www.chemotion-repository.net/inchikey/MFVBUTOBVQRHOJ-UHFFFAOYSA-N/CHMO0000597
Version
Author Martin Nieger
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T04:04:54.792070
MetadataModified 2024-09-07T19:11:07.200762
MetadataPublished 2020-10-29
Field Value
Measurement Technique 19F nuclear magnetic resonance spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
ALISAS CCDC
SCHEMBL1219442 SureChEMBL
87213257 PubChem
The data in this table is sourced from UniChem at EBI.