Dataset

heteronuclear multiple bond coherence (HMBC)

dataset for heteronuclear multiple bond coherence (HMBC)

Chemical Information

molecular Image
InChI InChI=1S/C21H22NP/c1-15-9-16(2)12-19(11-15)23(21-7-5-6-8-22-21)20-13-17(3)10-18(4)14-20/h5-14H,1-4H3
SMILES Cc1cc(C)cc(c1)P(c1cc(C)cc(c1)C)c1ccccn1
InChI Key QRDGLFDBJFMAHP-UHFFFAOYSA-N
Molecular Formula C21H22NP
Exact Mass 319.380 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/QRDGLFDBJFMAHP-UHFFFAOYSA-N/CHMO0000601
License URL
Source https://www.chemotion-repository.net/inchikey/QRDGLFDBJFMAHP-UHFFFAOYSA-N/CHMO0000601
Version
Author Jasmin Busch
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-10-29
Related Molecule
  • bis(3,5-dimethylphenyl)-pyridin-2-ylphosphane
    • Field Value
    Measurement Technique heteronuclear multiple bond coherence
    Measurement Variables
    Data-Source Molecule ID Data-Source
    87392450 PubChem
    SCHEMBL2467757 SureChEMBL
    The data in this table is sourced from UniChem at EBI.