Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C18H16NP/c1-15-12-13-19-18(14-15)20(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-14H,1H3
SMILES Cc1ccnc(c1)P(c1ccccc1)c1ccccc1
InChI Key PKLZMHUUPARTDZ-UHFFFAOYSA-N
Molecular Formula C18H16NP
Exact Mass 277.300 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/PKLZMHUUPARTDZ-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/PKLZMHUUPARTDZ-UHFFFAOYSA-N/CHMO0000595
Version
Author Jasmin Busch
Maintainer Chemotion Repository
Language english
MetadataPublished 2019-08-29
Related Molecule
  • (4-methylpyridin-2-yl)-diphenylphosphane
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    59088481 PubChem
    SCHEMBL10819826 SureChEMBL
    J2.082.087J Nikkaji
    The data in this table is sourced from UniChem at EBI.