Dataset

fast-atom bombardment mass spectrometry (FABMS)

dataset for fast-atom bombardment mass spectrometry (FABMS)

Chemical Information

molecular Image
InChI InChI=1S/C22H20N2O2/c25-24(26)21-13-11-20(12-14-21)23-22-15-18-6-5-16-1-3-17(4-2-16)7-9-19(22)10-8-18/h1-4,8,10-15,23H,5-7,9H2
SMILES [O-][N+](=O)c1ccc(cc1)Nc1cc2CCc3ccc(CCc1cc2)cc3
InChI Key JHKWAMLRTSXGOG-UHFFFAOYSA-N
Molecular Formula C22H20N2O2
Exact Mass 344.406 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/JHKWAMLRTSXGOG-UHFFFAOYSA-N/CHMO0000563
License URL
Source https://www.chemotion-repository.net/inchikey/JHKWAMLRTSXGOG-UHFFFAOYSA-N/CHMO0000563
Version
Author Jasmin Seibert
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-11-18
Related Molecule
  • N-(4-nitrophenyl)tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaen-5-amine
    • Field Value
    Measurement Technique fast-atom bombardment mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    167126123 PubChem
    SCHEMBL24548408 SureChEMBL
    The data in this table is sourced from UniChem at EBI.