Dataset

high-resolution mass spectrometry (HRMS)

dataset for high-resolution mass spectrometry (HRMS)

Chemical Information

molecular Image
InChI InChI=1S/C32H28N2/c1-21-19-31(27-9-13-33-14-10-27)23(3)17-29(21)25-5-7-26(8-6-25)30-18-24(4)32(20-22(30)2)28-11-15-34-16-12-28/h5-20H,1-4H3
SMILES Cc1cc(c(cc1c1ccc(cc1)c1cc(C)c(cc1C)c1ccncc1)C)c1ccncc1
InChI Key RVEJTWXBDCFTTO-UHFFFAOYSA-N
Molecular Formula C32H28N2
Exact Mass 440.578 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/RVEJTWXBDCFTTO-UHFFFAOYSA-N/CHMO0000498
License URL
Source https://www.chemotion-repository.net/inchikey/RVEJTWXBDCFTTO-UHFFFAOYSA-N/CHMO0000498
Version
Author Sylvain Grosjean
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-08-05
Related Molecule
  • 4-[4-[4-(2,5-dimethyl-4-pyridin-4-ylphenyl)phenyl]-2,5-dimethylphenyl]pyridine
    • Field Value
    Measurement Technique high-resolution mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    146681433 PubChem
    UTUQUY CCDC
    The data in this table is sourced from UniChem at EBI.