Dataset

high resolution fast-atom bombardment mass spectrometry (HRFABMS)

dataset for high resolution fast-atom bombardment mass spectrometry (HRFABMS)

Chemical Information

molecular Image
InChI InChI=1S/C46H42N6O2/c53-43-32-18-7-8-19-33(32)44(54)37-28-29(24-25-34(37)43)40-35(41-45(47-30-14-3-1-4-15-30)51-26-11-9-22-38(51)49-41)20-13-21-36(40)42-46(48-31-16-5-2-6-17-31)52-27-12-10-23-39(52)50-42/h7-13,18-28,30-31,47-48H,1-6,14-17H2
SMILES O=C1c2ccc(cc2C(=O)c2c1cccc2)c1c(cccc1c1nc2n(c1NC1CCCCC1)cccc2)c1nc2n(c1NC1CCCCC1)cccc2
InChI Key DKFXOUWDGJUHSG-UHFFFAOYSA-N
Molecular Formula C46H42N6O2
Exact Mass 710.865 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/DKFXOUWDGJUHSG-UHFFFAOYSA-N/CHMO0000726
License URL
Source https://www.chemotion-repository.net/inchikey/DKFXOUWDGJUHSG-UHFFFAOYSA-N/CHMO0000726
Version
Author Mareen Stahlberger
Maintainer Chemotion Repository
Language english
MetadataPublished 2023-10-02
Related Molecule
  • 2-[2,6-bis[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl]anthracene-9,10-dione
    • Field Value
    Measurement Technique high resolution fast-atom bombardment mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.