Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C20H11Cl4IO4/c21-12-6-13(22)9-17(8-12)28-19(26)25(16-4-2-1-3-5-16)20(27)29-18-10-14(23)7-15(24)11-18/h1-11H
SMILES Clc1cc(cc(c1)Cl)OC(=O)[I](C(=O)Oc1cc(Cl)cc(c1)Cl)c1ccccc1
InChI Key BVYYTSAIRFZNTB-UHFFFAOYSA-N
Molecular Formula C20H11Cl4IO4
Exact Mass 584.015 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/BVYYTSAIRFZNTB-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/BVYYTSAIRFZNTB-UHFFFAOYSA-N/CHMO0000595
Version
Author Vanessa Koch
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-05-21
Related Molecule
  • (3,5-dichlorophenyl) [(3,5-dichlorophenoxy)carbonyl-phenyl-lambda3-iodanyl]formate
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    175646785 pubchem
    The data in this table is sourced from UniChem at EBI.