Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Information

molecular Image
InChI InChI=1S/C25H20INO2/c26-15-8-16-27(17-19-9-2-1-3-10-19)25(28)29-18-24-22-13-6-4-11-20(22)21-12-5-7-14-23(21)24/h1-7,9-14,24H,16-18H2
SMILES IC#CCN(C(=O)OCC1c2ccccc2-c2c1cccc2)Cc1ccccc1
InChI Key JIWOBTANGURFHA-UHFFFAOYSA-N
Molecular Formula C25H20INO2
Exact Mass 493.336 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/JIWOBTANGURFHA-UHFFFAOYSA-N/NMR/1H/CDCl3/300
License URL
Source https://www.chemotion-repository.net/inchikey/JIWOBTANGURFHA-UHFFFAOYSA-N/NMR/1H/CDCl3/300
Version
Author Daniela Althuon
Maintainer Chemotion Repository
Language english
MetadataPublished 2014-05-27
Related Molecule
  • 9H-fluoren-9-ylmethyl N-benzyl-N-(3-iodoprop-2-ynyl)carbamate
    • Field Value
    Measurement Technique 1H nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    73427454 PubChem
    The data in this table is sourced from UniChem at EBI.