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/C29H26N4/c1-2-4-24(5-3-1)19-31-29-28(32-27-20-30-16-17-33(27)29)26-18-23-11-10-21-6-8-22(9-7-21)12-14-25(26)15-13-23/h1-9,13,15-18,20,31H,10-12,14,19H2
SMILES c1ccc(cc1)CNc1c(nc2n1ccnc2)c1cc2ccc1CCc1ccc(CC2)cc1
InChI Key AXKWWZKTOILSMH-UHFFFAOYSA-N
Molecular Formula C29H26N4
Exact Mass 430.544 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/AXKWWZKTOILSMH-UHFFFAOYSA-N/CHMO0000726
License URL
Source https://www.chemotion-repository.net/inchikey/AXKWWZKTOILSMH-UHFFFAOYSA-N/CHMO0000726
Version
Author Mareen Stahlberger
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-07-25
Related Molecule
  • N-benzyl-2-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)imidazo[1,2-a]pyrazin-3-amine
    • Field Value
    Measurement Technique high resolution fast-atom bombardment mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    164889657 PubChem
    The data in this table is sourced from UniChem at EBI.