Dataset

proton-decoupled 31P nuclear magnetic resonance spectroscopy (31P{1H}-NMR)

dataset for proton-decoupled 31P nuclear magnetic resonance spectroscopy (31P{1H}-NMR)

Chemical Information

molecular Image
InChI InChI=1S/C22H29N5O2.C2H3N.Cu.F6P/c1-21(2,3)17-11-13-26(24-17)19(27-14-12-18(25-27)22(4,5)6)15-9-8-10-16(23-15)20(28)29-7;1-2-3;;1-7(2,3,4,5)6/h8-14,19H,1-7H3;1H3;;/q;;+1;-1
SMILES F[P-](F)(F)(F)(F)F.COC(=O)c1cccc(n1)C(n1ccc(n1)C(C)(C)C)n1ccc(n1)C(C)(C)C.CC#N.[Cu+]
InChI Key UQZCBWVOIVXJNI-UHFFFAOYSA-N
Molecular Formula C24H32CuF6N6O2P
Exact Mass 645.060 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/UQZCBWVOIVXJNI-UHFFFAOYSA-N/CHMO0000889
License URL
Source https://www.chemotion-repository.net/inchikey/UQZCBWVOIVXJNI-UHFFFAOYSA-N/CHMO0000889
Version
Author Sonja Herres-Pawlis
Maintainer Chemotion Repository
Language english
MetadataPublished 2021-10-16
Related Molecule
  • acetonitrile;copper(1+);methyl 6-[bis(3-tert-butylpyrazol-1-yl)methyl]pyridine-2-carboxylate;hexafluorophosphate
    • Field Value
    Measurement Technique proton-decoupled 31P nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    156619349 PubChem
    The data in this table is sourced from UniChem at EBI.