Dataset

high-resolution mass spectrometry (HRMS)

dataset for high-resolution mass spectrometry (HRMS)

Chemical Information

molecular Image
InChI InChI=1S/C24H21N3/c1-2-4-22(5-3-1)27-24(17-25-26-27)23-16-20-11-10-18-6-8-19(9-7-18)12-14-21(23)15-13-20/h1-9,13,15-17H,10-12,14H2
SMILES c1ccc(cc1)n1nncc1c1cc2ccc1CCc1ccc(CC2)cc1
InChI Key YNTDRBUGPFYKLY-UHFFFAOYSA-N
Molecular Formula C24H21N3
Exact Mass 351.444 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/YNTDRBUGPFYKLY-UHFFFAOYSA-N/CHMO0000498.1
License URL
Source https://www.chemotion-repository.net/inchikey/YNTDRBUGPFYKLY-UHFFFAOYSA-N/CHMO0000498.1
Version
Author Sylvia Vanderheiden-Schroen
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-02-11
Related Molecule
  • 1-phenyl-5-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)triazole
    • Field Value
    Measurement Technique high-resolution mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    71615771 PubChem
    J3.172.238A Nikkaji
    The data in this table is sourced from UniChem at EBI.