Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

molecular Image
InChI InChI=1S/C14H20N4.2BrH.Zn/c1-17-9-10-18(2)14(17)16-12-7-3-5-11-6-4-8-15-13(11)12;;;/h4,6,8,12H,3,5,7,9-10H2,1-2H3;2*1H;/q;;;+2/p-2
SMILES CN1CCN(C1=NC1CCCc2c1nccc2)C.Br[Zn]Br
InChI Key DTLOYKSPTOULJM-UHFFFAOYSA-L
Molecular Formula C14H20Br2N4Zn
Exact Mass 469.523 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/DTLOYKSPTOULJM-UHFFFAOYSA-L/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/DTLOYKSPTOULJM-UHFFFAOYSA-L/CHMO0000595
Version
Author Sonja Herres-Pawlis
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-07-14
Related Molecule
  • dibromozinc;1,3-dimethyl-N-(5,6,7,8-tetrahydroquinolin-8-yl)imidazolidin-2-imine
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    164510636 PubChem
    The data in this table is sourced from UniChem at EBI.