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/c1-22-19-12-8-17(9-13-19)21(16-6-4-3-5-7-16)18-10-14-20(23-2)15-11-18/h3-15H,1-2H3
SMILES COc1ccc(cc1)N(c1ccc(cc1)OC)c1ccccc1
InChI Key ZJPTYHDCQPDNBH-UHFFFAOYSA-N
Molecular Formula C20H19NO2
Exact Mass 305.370 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/ZJPTYHDCQPDNBH-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/ZJPTYHDCQPDNBH-UHFFFAOYSA-N/CHMO0000595
Version
Author Henrik Tappert
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-02-26
Related Molecule
  • 4-methoxy-N-(4-methoxyphenyl)-N-phenylaniline
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Title : Mar27-2024

    Date : 20240328

    Start time : 1.25 h

    Label : HT-1194

    ID : 288362

    Solvent : chloroform-D1 (CDCl3)

    Temperature : 298.0 K K

    Puls programme : zgpg30

    Number of scans : 1024

    Instrument : Avance NEO

    Data-Source Molecule ID Data-Source
    578164 surechembl
    10543043 pubchem
    Molport-023-333-376 molport
    The data in this table is sourced from UniChem at EBI.