Dataset

19F nuclear magnetic resonance spectroscopy (19F NMR)

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

Chemical Info

molecular Image
InChI InChI=1S/C16H14BBrF3.K/c18-16-10-12-2-6-13-5-1-11(3-7-14(16)8-4-12)9-15(13)17(19,20)21;/h1,4-5,8-10H,2-3,6-7H2;/q-1;+1
SMILES Brc1cc2CCc3ccc(CCc1cc2)cc3[B-](F)(F)F.[K+]
InChI Key MXMAXVNQPZJOHU-UHFFFAOYSA-N
Molecular Formula C16H14BBrF3K
Exact Mass 393.091 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/MXMAXVNQPZJOHU-UHFFFAOYSA-N/CHMO0000597.1
License URL
Source https://www.chemotion-repository.net/inchikey/MXMAXVNQPZJOHU-UHFFFAOYSA-N/CHMO0000597.1
Version
Author Daniel Knoll
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-07-13
Related Molecule
  • potassium;(11-bromo-5-tricyclo[8.2.2.24,7]hexadeca-1(12),4,6,10,13,15-hexaenyl)-trifluoroboranuide
    • Field Value
    Measurement Technique 19F nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    138453689 PubChem
    The data in this table is sourced from UniChem at EBI.