Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C20H19NO2/c1-3-11-18(20(22)23-4-2)21-19(16-12-7-5-8-13-16)17-14-9-6-10-15-17/h1,5-10,12-15,18H,4,11H2,2H3
SMILES CCOC(=O)C(N=C(c1ccccc1)c1ccccc1)CC#C
InChI Key NRSOKXSYKBYBOO-UHFFFAOYSA-N
Molecular Formula C20H19NO2
Exact Mass 305.370 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/NRSOKXSYKBYBOO-UHFFFAOYSA-N/NMR/13C/CDCl3/62.5.1
License URL
Source https://www.chemotion-repository.net/inchikey/NRSOKXSYKBYBOO-UHFFFAOYSA-N/NMR/13C/CDCl3/62.5.1
Version
Author Irina Protasova
Maintainer Chemotion Repository
Language english
MetadataPublished 2015-05-11
Related Molecule
  • ethyl 2-(benzhydrylideneamino)pent-4-ynoate
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    12761879 surechembl
    11833691 pubchem
    The data in this table is sourced from UniChem at EBI.